USER MOD reduce.3.24.130724 H: found=0, std=0, add=1029, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1029 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 131 HIS : no HD1:sc= -0.285 K(o=0.66,f=-4.2!) USER MOD Set 1.2: A 142 CYS SG : rot 130:sc= -1.41! USER MOD Set 1.3: A 143 CYS SG : rot -60:sc= 0.757 USER MOD Set 1.4: A 145 GLN : amide:sc= 1.06 K(o=0.66,f=-0.84) USER MOD Set 1.5: A 153 CYS SG : rot -73:sc= 0.539 USER MOD Set 2.1: A 71 CYS SG : rot -149:sc= -0.25 USER MOD Set 2.2: A 127 MET CE :methyl -175:sc= -0.773 (180deg=-1.1) USER MOD Set 3.1: A 123 ASN : amide:sc= -0.502 K(o=-1.6,f=-3.9!) USER MOD Set 3.2: A 125 ASN : amide:sc= -1.08 K(o=-1.6,f=-4.6!) USER MOD Set 4.1: A 121 LYS NZ :NH3+ 142:sc= 0.479 (180deg=-0.165) USER MOD Set 4.2: A 122 ASN : amide:sc= -0.576! C(o=-0.097!,f=-10!) USER MOD Set 5.1: A 117 LYS NZ :NH3+ -119:sc= 0.602 (180deg=0.195) USER MOD Set 5.2: A 156 TYR OH : rot -1:sc= 0.501 USER MOD Single : A 15 THR OG1 : rot 37:sc= 1.17 USER MOD Single : A 23 LYS NZ :NH3+ -172:sc= -0.0528 (180deg=-0.161) USER MOD Single : A 25 SER OG : rot 85:sc= 0.00485 USER MOD Single : A 35 ASN : amide:sc= 0 X(o=0,f=-0.37) USER MOD Single : A 36 TYR OH : rot 130:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ 169:sc=-0.00073 (180deg=-0.121) USER MOD Single : A 44 THR OG1 : rot -25:sc= 1.22 USER MOD Single : A 45 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00538) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 47 MET CE :methyl -161:sc= -0.145 (180deg=-0.672) USER MOD Single : A 49 THR OG1 : rot 180:sc= 0 USER MOD Single : A 50 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0459) USER MOD Single : A 76 LYS NZ :NH3+ -144:sc= -0.768 (180deg=-2.64!) USER MOD Single : A 84 CYS SG : rot 180:sc= -0.164 USER MOD Single : A 85 GLN :FLIP amide:sc= -0.383 F(o=-1.5!,f=-0.38) USER MOD Single : A 86 ASN : amide:sc= -0.401 K(o=-0.4,f=-3.2!) USER MOD Single : A 87 LYS NZ :NH3+ 165:sc= 0.91 (180deg=0.755) USER MOD Single : A 88 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 GLN : amide:sc= -1.05 X(o=-1.1,f=-0.56) USER MOD Single : A 94 HIS : no HE2:sc= -0.832 K(o=-0.83,f=-2.1!) USER MOD Single : A 97 ASN : amide:sc= 0 X(o=0,f=-0.02) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 TYR OH : rot -45:sc= 0.782 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 107 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 108 SER OG : rot 180:sc= -0.803 USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 ASN : amide:sc= -0.417 X(o=-0.42,f=0) USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 TYR OH : rot 61:sc= 0.438 USER MOD Single : A 133 LYS NZ :NH3+ -170:sc= -0.0219 (180deg=-0.0988) USER MOD Single : A 136 THR OG1 : rot 180:sc= -0.189 USER MOD Single : A 139 SER OG : rot -89:sc= 0.11 USER MOD Single : A 140 TYR OH : rot 180:sc= 0 USER MOD Single : A 141 GLN :FLIP amide:sc= -0.137 F(o=-3.2!,f=-0.14) USER MOD Single : A 146 THR OG1 : rot -32:sc= 0.524 USER MOD Single : A 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 155 LYS NZ :NH3+ -175:sc= 0.0716 (180deg=0.066) USER MOD Single : A 157 ASN : amide:sc= -0.331 X(o=-0.33,f=-0.51) USER MOD ----------------------------------------------------------------- ATOM 229 N THR A 15 -9.920 -0.488 15.090 1.00 75.04 N ATOM 230 CA THR A 15 -9.359 -0.571 13.742 1.00 43.40 C ATOM 231 C THR A 15 -10.053 0.454 12.836 1.00 74.01 C ATOM 232 O THR A 15 -11.233 0.772 13.016 1.00 62.32 O ATOM 233 CB THR A 15 -9.487 -2.026 13.155 1.00 13.12 C ATOM 234 OG1 THR A 15 -9.042 -2.068 11.786 1.00 52.34 O ATOM 235 CG2 THR A 15 -10.922 -2.577 13.245 1.00 10.41 C ATOM 0 HA THR A 15 -8.295 -0.340 13.790 1.00 43.40 H new ATOM 0 HB THR A 15 -8.847 -2.661 13.768 1.00 13.12 H new ATOM 0 HG1 THR A 15 -8.273 -1.471 11.674 1.00 52.34 H new ATOM 0 HG21 THR A 15 -10.952 -3.583 12.826 1.00 10.41 H new ATOM 0 HG22 THR A 15 -11.235 -2.609 14.289 1.00 10.41 H new ATOM 0 HG23 THR A 15 -11.596 -1.930 12.684 1.00 10.41 H new ATOM 243 N ILE A 16 -9.284 0.996 11.899 1.00 41.32 N ATOM 244 CA ILE A 16 -9.751 1.978 10.914 1.00 2.32 C ATOM 245 C ILE A 16 -10.451 1.252 9.758 1.00 24.40 C ATOM 246 O ILE A 16 -11.518 1.675 9.293 1.00 35.13 O ATOM 247 CB ILE A 16 -8.524 2.802 10.387 1.00 43.44 C ATOM 248 CG1 ILE A 16 -7.762 3.443 11.590 1.00 2.45 C ATOM 249 CG2 ILE A 16 -8.945 3.868 9.344 1.00 71.40 C ATOM 250 CD1 ILE A 16 -6.445 4.087 11.234 1.00 24.50 C ATOM 0 H ILE A 16 -8.296 0.763 11.796 1.00 41.32 H new ATOM 0 HA ILE A 16 -10.463 2.661 11.377 1.00 2.32 H new ATOM 0 HB ILE A 16 -7.850 2.119 9.871 1.00 43.44 H new ATOM 0 HG12 ILE A 16 -8.405 4.193 12.051 1.00 2.45 H new ATOM 0 HG13 ILE A 16 -7.583 2.673 12.340 1.00 2.45 H new ATOM 0 HG21 ILE A 16 -8.064 4.415 9.007 1.00 71.40 H new ATOM 0 HG22 ILE A 16 -9.416 3.377 8.492 1.00 71.40 H new ATOM 0 HG23 ILE A 16 -9.651 4.563 9.799 1.00 71.40 H new ATOM 0 HD11 ILE A 16 -5.990 4.504 12.132 1.00 24.50 H new ATOM 0 HD12 ILE A 16 -5.779 3.339 10.803 1.00 24.50 H new ATOM 0 HD13 ILE A 16 -6.614 4.883 10.509 1.00 24.50 H new ATOM 262 N LEU A 17 -9.838 0.135 9.332 1.00 23.35 N ATOM 263 CA LEU A 17 -10.317 -0.667 8.201 1.00 50.42 C ATOM 264 C LEU A 17 -9.604 -2.027 8.194 1.00 52.43 C ATOM 265 O LEU A 17 -8.391 -2.090 8.406 1.00 23.11 O ATOM 266 CB LEU A 17 -10.070 0.088 6.861 1.00 30.14 C ATOM 267 CG LEU A 17 -10.600 -0.597 5.566 1.00 4.34 C ATOM 268 CD1 LEU A 17 -12.124 -0.857 5.633 1.00 51.23 C ATOM 269 CD2 LEU A 17 -10.210 0.230 4.322 1.00 54.45 C ATOM 0 H LEU A 17 -8.993 -0.236 9.766 1.00 23.35 H new ATOM 0 HA LEU A 17 -11.389 -0.832 8.307 1.00 50.42 H new ATOM 0 HB2 LEU A 17 -10.528 1.074 6.936 1.00 30.14 H new ATOM 0 HB3 LEU A 17 -8.997 0.242 6.750 1.00 30.14 H new ATOM 0 HG LEU A 17 -10.125 -1.575 5.483 1.00 4.34 H new ATOM 0 HD11 LEU A 17 -12.452 -1.336 4.710 1.00 51.23 H new ATOM 0 HD12 LEU A 17 -12.345 -1.509 6.478 1.00 51.23 H new ATOM 0 HD13 LEU A 17 -12.650 0.090 5.757 1.00 51.23 H new ATOM 0 HD21 LEU A 17 -10.587 -0.262 3.425 1.00 54.45 H new ATOM 0 HD22 LEU A 17 -10.642 1.228 4.398 1.00 54.45 H new ATOM 0 HD23 LEU A 17 -9.124 0.309 4.263 1.00 54.45 H new ATOM 281 N GLU A 18 -10.365 -3.106 7.954 1.00 60.00 N ATOM 282 CA GLU A 18 -9.829 -4.474 7.823 1.00 71.44 C ATOM 283 C GLU A 18 -10.493 -5.147 6.610 1.00 13.45 C ATOM 284 O GLU A 18 -11.719 -5.136 6.474 1.00 13.43 O ATOM 285 CB GLU A 18 -10.044 -5.302 9.133 1.00 32.22 C ATOM 286 CG GLU A 18 -11.496 -5.716 9.474 1.00 52.44 C ATOM 287 CD GLU A 18 -12.436 -4.535 9.792 1.00 3.35 C ATOM 288 OE1 GLU A 18 -13.068 -3.981 8.868 1.00 20.13 O ATOM 289 OE2 GLU A 18 -12.562 -4.175 10.969 1.00 3.21 O ATOM 0 H GLU A 18 -11.378 -3.055 7.844 1.00 60.00 H new ATOM 0 HA GLU A 18 -8.752 -4.428 7.664 1.00 71.44 H new ATOM 0 HB2 GLU A 18 -9.441 -6.208 9.064 1.00 32.22 H new ATOM 0 HB3 GLU A 18 -9.652 -4.722 9.968 1.00 32.22 H new ATOM 0 HG2 GLU A 18 -11.908 -6.277 8.635 1.00 52.44 H new ATOM 0 HG3 GLU A 18 -11.477 -6.391 10.330 1.00 52.44 H new ATOM 296 N GLU A 19 -9.671 -5.692 5.704 1.00 33.32 N ATOM 297 CA GLU A 19 -10.132 -6.319 4.442 1.00 31.11 C ATOM 298 C GLU A 19 -9.190 -7.448 4.024 1.00 63.11 C ATOM 299 O GLU A 19 -8.074 -7.569 4.534 1.00 75.34 O ATOM 300 CB GLU A 19 -10.221 -5.278 3.288 1.00 65.34 C ATOM 301 CG GLU A 19 -11.358 -4.244 3.414 1.00 74.15 C ATOM 302 CD GLU A 19 -12.764 -4.858 3.257 1.00 51.51 C ATOM 303 OE1 GLU A 19 -13.045 -5.437 2.191 1.00 31.42 O ATOM 304 OE2 GLU A 19 -13.594 -4.747 4.174 1.00 22.00 O ATOM 0 H GLU A 19 -8.658 -5.714 5.820 1.00 33.32 H new ATOM 0 HA GLU A 19 -11.127 -6.723 4.629 1.00 31.11 H new ATOM 0 HB2 GLU A 19 -9.273 -4.744 3.230 1.00 65.34 H new ATOM 0 HB3 GLU A 19 -10.343 -5.814 2.347 1.00 65.34 H new ATOM 0 HG2 GLU A 19 -11.289 -3.756 4.386 1.00 74.15 H new ATOM 0 HG3 GLU A 19 -11.221 -3.470 2.659 1.00 74.15 H new ATOM 311 N ILE A 20 -9.670 -8.261 3.076 1.00 35.54 N ATOM 312 CA ILE A 20 -8.893 -9.335 2.454 1.00 64.34 C ATOM 313 C ILE A 20 -8.253 -8.780 1.170 1.00 73.14 C ATOM 314 O ILE A 20 -8.948 -8.549 0.177 1.00 43.12 O ATOM 315 CB ILE A 20 -9.797 -10.584 2.117 1.00 11.41 C ATOM 316 CG1 ILE A 20 -10.492 -11.163 3.398 1.00 4.55 C ATOM 317 CG2 ILE A 20 -8.986 -11.682 1.396 1.00 25.44 C ATOM 318 CD1 ILE A 20 -9.554 -11.766 4.432 1.00 43.32 C ATOM 0 H ILE A 20 -10.622 -8.189 2.716 1.00 35.54 H new ATOM 0 HA ILE A 20 -8.125 -9.673 3.150 1.00 64.34 H new ATOM 0 HB ILE A 20 -10.581 -10.238 1.443 1.00 11.41 H new ATOM 0 HG12 ILE A 20 -11.064 -10.366 3.872 1.00 4.55 H new ATOM 0 HG13 ILE A 20 -11.205 -11.927 3.090 1.00 4.55 H new ATOM 0 HG21 ILE A 20 -9.636 -12.529 1.177 1.00 25.44 H new ATOM 0 HG22 ILE A 20 -8.582 -11.284 0.465 1.00 25.44 H new ATOM 0 HG23 ILE A 20 -8.167 -12.009 2.036 1.00 25.44 H new ATOM 0 HD11 ILE A 20 -10.134 -12.137 5.277 1.00 43.32 H new ATOM 0 HD12 ILE A 20 -8.999 -12.590 3.983 1.00 43.32 H new ATOM 0 HD13 ILE A 20 -8.856 -11.004 4.778 1.00 43.32 H new ATOM 330 N LEU A 21 -6.944 -8.513 1.226 1.00 53.02 N ATOM 331 CA LEU A 21 -6.164 -7.980 0.090 1.00 54.14 C ATOM 332 C LEU A 21 -5.084 -9.000 -0.314 1.00 40.15 C ATOM 333 O LEU A 21 -4.776 -9.917 0.445 1.00 13.01 O ATOM 334 CB LEU A 21 -5.485 -6.646 0.494 1.00 54.34 C ATOM 335 CG LEU A 21 -6.384 -5.547 1.145 1.00 51.43 C ATOM 336 CD1 LEU A 21 -5.524 -4.392 1.698 1.00 4.24 C ATOM 337 CD2 LEU A 21 -7.453 -5.029 0.162 1.00 50.45 C ATOM 0 H LEU A 21 -6.385 -8.660 2.067 1.00 53.02 H new ATOM 0 HA LEU A 21 -6.834 -7.801 -0.751 1.00 54.14 H new ATOM 0 HB2 LEU A 21 -4.678 -6.876 1.190 1.00 54.34 H new ATOM 0 HB3 LEU A 21 -5.025 -6.220 -0.397 1.00 54.34 H new ATOM 0 HG LEU A 21 -6.912 -6.005 1.981 1.00 51.43 H new ATOM 0 HD11 LEU A 21 -6.172 -3.639 2.147 1.00 4.24 H new ATOM 0 HD12 LEU A 21 -4.839 -4.778 2.453 1.00 4.24 H new ATOM 0 HD13 LEU A 21 -4.953 -3.942 0.886 1.00 4.24 H new ATOM 0 HD21 LEU A 21 -8.058 -4.266 0.652 1.00 50.45 H new ATOM 0 HD22 LEU A 21 -6.965 -4.599 -0.713 1.00 50.45 H new ATOM 0 HD23 LEU A 21 -8.092 -5.855 -0.149 1.00 50.45 H new ATOM 349 N ILE A 22 -4.484 -8.811 -1.494 1.00 10.42 N ATOM 350 CA ILE A 22 -3.355 -9.640 -1.958 1.00 13.43 C ATOM 351 C ILE A 22 -2.034 -8.921 -1.691 1.00 41.52 C ATOM 352 O ILE A 22 -1.885 -7.742 -2.000 1.00 61.43 O ATOM 353 CB ILE A 22 -3.483 -10.020 -3.491 1.00 55.02 C ATOM 354 CG1 ILE A 22 -4.584 -11.112 -3.666 1.00 62.21 C ATOM 355 CG2 ILE A 22 -2.128 -10.464 -4.122 1.00 62.11 C ATOM 356 CD1 ILE A 22 -4.646 -11.744 -5.038 1.00 25.13 C ATOM 0 H ILE A 22 -4.762 -8.085 -2.154 1.00 10.42 H new ATOM 0 HA ILE A 22 -3.377 -10.573 -1.395 1.00 13.43 H new ATOM 0 HB ILE A 22 -3.777 -9.122 -4.034 1.00 55.02 H new ATOM 0 HG12 ILE A 22 -4.416 -11.897 -2.928 1.00 62.21 H new ATOM 0 HG13 ILE A 22 -5.554 -10.667 -3.443 1.00 62.21 H new ATOM 0 HG21 ILE A 22 -2.280 -10.711 -5.173 1.00 62.11 H new ATOM 0 HG22 ILE A 22 -1.405 -9.652 -4.041 1.00 62.11 H new ATOM 0 HG23 ILE A 22 -1.750 -11.340 -3.594 1.00 62.11 H new ATOM 0 HD11 ILE A 22 -5.441 -12.489 -5.060 1.00 25.13 H new ATOM 0 HD12 ILE A 22 -4.848 -10.975 -5.784 1.00 25.13 H new ATOM 0 HD13 ILE A 22 -3.693 -12.224 -5.261 1.00 25.13 H new ATOM 368 N LYS A 23 -1.088 -9.653 -1.101 1.00 12.03 N ATOM 369 CA LYS A 23 0.289 -9.203 -0.919 1.00 54.23 C ATOM 370 C LYS A 23 1.144 -9.731 -2.085 1.00 61.31 C ATOM 371 O LYS A 23 0.962 -10.881 -2.522 1.00 4.20 O ATOM 372 CB LYS A 23 0.836 -9.737 0.430 1.00 63.41 C ATOM 373 CG LYS A 23 2.249 -9.232 0.776 1.00 12.42 C ATOM 374 CD LYS A 23 2.820 -9.849 2.069 1.00 72.41 C ATOM 375 CE LYS A 23 4.261 -9.384 2.333 1.00 13.31 C ATOM 376 NZ LYS A 23 5.170 -9.725 1.201 1.00 34.35 N ATOM 0 H LYS A 23 -1.261 -10.588 -0.732 1.00 12.03 H new ATOM 0 HA LYS A 23 0.327 -8.114 -0.906 1.00 54.23 H new ATOM 0 HB2 LYS A 23 0.152 -9.447 1.228 1.00 63.41 H new ATOM 0 HB3 LYS A 23 0.848 -10.827 0.400 1.00 63.41 H new ATOM 0 HG2 LYS A 23 2.920 -9.457 -0.053 1.00 12.42 H new ATOM 0 HG3 LYS A 23 2.224 -8.147 0.880 1.00 12.42 H new ATOM 0 HD2 LYS A 23 2.188 -9.573 2.913 1.00 72.41 H new ATOM 0 HD3 LYS A 23 2.796 -10.936 1.995 1.00 72.41 H new ATOM 0 HE2 LYS A 23 4.271 -8.306 2.495 1.00 13.31 H new ATOM 0 HE3 LYS A 23 4.630 -9.847 3.248 1.00 13.31 H new ATOM 0 HZ1 LYS A 23 6.153 -9.519 1.471 1.00 34.35 H new ATOM 0 HZ2 LYS A 23 5.078 -10.736 0.974 1.00 34.35 H new ATOM 0 HZ3 LYS A 23 4.914 -9.158 0.367 1.00 34.35 H new ATOM 390 N ARG A 24 2.074 -8.898 -2.578 1.00 54.12 N ATOM 391 CA ARG A 24 3.041 -9.316 -3.606 1.00 21.32 C ATOM 392 C ARG A 24 4.215 -10.036 -2.912 1.00 70.42 C ATOM 393 O ARG A 24 4.609 -9.665 -1.788 1.00 4.44 O ATOM 394 CB ARG A 24 3.569 -8.087 -4.406 1.00 53.11 C ATOM 395 CG ARG A 24 4.409 -8.451 -5.657 1.00 2.23 C ATOM 396 CD ARG A 24 5.078 -7.234 -6.325 1.00 31.20 C ATOM 397 NE ARG A 24 6.118 -6.636 -5.462 1.00 71.13 N ATOM 398 CZ ARG A 24 7.246 -6.039 -5.899 1.00 50.42 C ATOM 399 NH1 ARG A 24 7.516 -5.941 -7.198 1.00 64.25 N ATOM 400 NH2 ARG A 24 8.100 -5.542 -5.018 1.00 20.34 N ATOM 0 H ARG A 24 2.177 -7.928 -2.280 1.00 54.12 H new ATOM 0 HA ARG A 24 2.550 -9.987 -4.310 1.00 21.32 H new ATOM 0 HB2 ARG A 24 2.719 -7.479 -4.718 1.00 53.11 H new ATOM 0 HB3 ARG A 24 4.176 -7.470 -3.743 1.00 53.11 H new ATOM 0 HG2 ARG A 24 5.179 -9.167 -5.372 1.00 2.23 H new ATOM 0 HG3 ARG A 24 3.766 -8.947 -6.384 1.00 2.23 H new ATOM 0 HD2 ARG A 24 5.523 -7.539 -7.272 1.00 31.20 H new ATOM 0 HD3 ARG A 24 4.321 -6.484 -6.555 1.00 31.20 H new ATOM 0 HE ARG A 24 5.971 -6.678 -4.454 1.00 71.13 H new ATOM 0 HH11 ARG A 24 6.864 -6.321 -7.884 1.00 64.25 H new ATOM 0 HH12 ARG A 24 8.375 -5.486 -7.507 1.00 64.25 H new ATOM 0 HH21 ARG A 24 7.902 -5.613 -4.020 1.00 20.34 H new ATOM 0 HH22 ARG A 24 8.956 -5.089 -5.337 1.00 20.34 H new ATOM 414 N SER A 25 4.762 -11.060 -3.578 1.00 24.11 N ATOM 415 CA SER A 25 5.958 -11.770 -3.114 1.00 35.34 C ATOM 416 C SER A 25 7.174 -11.037 -3.693 1.00 42.24 C ATOM 417 O SER A 25 7.210 -10.780 -4.902 1.00 53.24 O ATOM 418 CB SER A 25 5.916 -13.244 -3.580 1.00 13.44 C ATOM 419 OG SER A 25 4.735 -13.889 -3.124 1.00 21.31 O ATOM 0 H SER A 25 4.386 -11.420 -4.455 1.00 24.11 H new ATOM 0 HA SER A 25 6.012 -11.780 -2.025 1.00 35.34 H new ATOM 0 HB2 SER A 25 5.961 -13.286 -4.668 1.00 13.44 H new ATOM 0 HB3 SER A 25 6.792 -13.773 -3.204 1.00 13.44 H new ATOM 0 HG SER A 25 4.004 -13.717 -3.754 1.00 21.31 H new ATOM 583 N ASN A 35 4.852 -13.690 -8.106 1.00 35.33 N ATOM 584 CA ASN A 35 3.886 -14.519 -7.380 1.00 14.12 C ATOM 585 C ASN A 35 3.018 -13.620 -6.491 1.00 51.21 C ATOM 586 O ASN A 35 3.524 -12.702 -5.832 1.00 23.31 O ATOM 587 CB ASN A 35 4.604 -15.602 -6.534 1.00 72.43 C ATOM 588 CG ASN A 35 3.633 -16.544 -5.803 1.00 41.11 C ATOM 589 OD1 ASN A 35 2.535 -16.835 -6.288 1.00 35.23 O ATOM 590 ND2 ASN A 35 4.020 -17.021 -4.632 1.00 50.23 N ATOM 0 HA ASN A 35 3.251 -15.037 -8.099 1.00 14.12 H new ATOM 0 HB2 ASN A 35 5.251 -16.191 -7.184 1.00 72.43 H new ATOM 0 HB3 ASN A 35 5.247 -15.114 -5.801 1.00 72.43 H new ATOM 0 HD21 ASN A 35 3.407 -17.645 -4.107 1.00 50.23 H new ATOM 0 HD22 ASN A 35 4.932 -16.765 -4.253 1.00 50.23 H new ATOM 597 N TYR A 36 1.712 -13.883 -6.492 1.00 2.03 N ATOM 598 CA TYR A 36 0.720 -13.112 -5.736 1.00 52.31 C ATOM 599 C TYR A 36 -0.036 -14.072 -4.819 1.00 0.23 C ATOM 600 O TYR A 36 -0.402 -15.179 -5.247 1.00 33.12 O ATOM 601 CB TYR A 36 -0.269 -12.417 -6.705 1.00 40.24 C ATOM 602 CG TYR A 36 0.397 -11.613 -7.834 1.00 22.35 C ATOM 603 CD1 TYR A 36 1.123 -10.451 -7.566 1.00 54.15 C ATOM 604 CD2 TYR A 36 0.284 -12.013 -9.169 1.00 35.12 C ATOM 605 CE1 TYR A 36 1.704 -9.721 -8.587 1.00 73.31 C ATOM 606 CE2 TYR A 36 0.858 -11.277 -10.188 1.00 41.13 C ATOM 607 CZ TYR A 36 1.563 -10.135 -9.893 1.00 11.02 C ATOM 608 OH TYR A 36 2.124 -9.396 -10.913 1.00 30.31 O ATOM 0 H TYR A 36 1.304 -14.650 -7.026 1.00 2.03 H new ATOM 0 HA TYR A 36 1.218 -12.342 -5.146 1.00 52.31 H new ATOM 0 HB2 TYR A 36 -0.915 -13.175 -7.149 1.00 40.24 H new ATOM 0 HB3 TYR A 36 -0.910 -11.748 -6.131 1.00 40.24 H new ATOM 0 HD1 TYR A 36 1.233 -10.117 -6.545 1.00 54.15 H new ATOM 0 HD2 TYR A 36 -0.262 -12.914 -9.408 1.00 35.12 H new ATOM 0 HE1 TYR A 36 2.267 -8.828 -8.361 1.00 73.31 H new ATOM 0 HE2 TYR A 36 0.753 -11.599 -11.214 1.00 41.13 H new ATOM 0 HH TYR A 36 2.645 -9.986 -11.496 1.00 30.31 H new ATOM 618 N LYS A 37 -0.277 -13.660 -3.568 1.00 32.12 N ATOM 619 CA LYS A 37 -0.977 -14.501 -2.587 1.00 64.21 C ATOM 620 C LYS A 37 -1.918 -13.636 -1.743 1.00 23.23 C ATOM 621 O LYS A 37 -1.631 -12.471 -1.476 1.00 21.34 O ATOM 622 CB LYS A 37 0.043 -15.273 -1.696 1.00 20.25 C ATOM 623 CG LYS A 37 -0.530 -16.560 -1.062 1.00 30.14 C ATOM 624 CD LYS A 37 -0.855 -17.634 -2.131 1.00 13.34 C ATOM 625 CE LYS A 37 -1.636 -18.827 -1.571 1.00 54.20 C ATOM 626 NZ LYS A 37 -2.995 -18.440 -1.122 1.00 43.25 N ATOM 0 H LYS A 37 0.003 -12.747 -3.210 1.00 32.12 H new ATOM 0 HA LYS A 37 -1.575 -15.244 -3.114 1.00 64.21 H new ATOM 0 HB2 LYS A 37 0.913 -15.533 -2.298 1.00 20.25 H new ATOM 0 HB3 LYS A 37 0.391 -14.612 -0.902 1.00 20.25 H new ATOM 0 HG2 LYS A 37 0.188 -16.964 -0.348 1.00 30.14 H new ATOM 0 HG3 LYS A 37 -1.434 -16.318 -0.503 1.00 30.14 H new ATOM 0 HD2 LYS A 37 -1.432 -17.175 -2.934 1.00 13.34 H new ATOM 0 HD3 LYS A 37 0.076 -17.992 -2.572 1.00 13.34 H new ATOM 0 HE2 LYS A 37 -1.713 -19.601 -2.335 1.00 54.20 H new ATOM 0 HE3 LYS A 37 -1.087 -19.259 -0.734 1.00 54.20 H new ATOM 0 HZ1 LYS A 37 -3.553 -19.296 -0.926 1.00 43.25 H new ATOM 0 HZ2 LYS A 37 -2.925 -17.867 -0.257 1.00 43.25 H new ATOM 0 HZ3 LYS A 37 -3.462 -17.886 -1.868 1.00 43.25 H new ATOM 640 N GLU A 38 -3.011 -14.248 -1.277 1.00 2.43 N ATOM 641 CA GLU A 38 -4.148 -13.536 -0.677 1.00 44.11 C ATOM 642 C GLU A 38 -4.051 -13.610 0.854 1.00 70.15 C ATOM 643 O GLU A 38 -3.612 -14.634 1.403 1.00 55.13 O ATOM 644 CB GLU A 38 -5.464 -14.158 -1.197 1.00 62.42 C ATOM 645 CG GLU A 38 -6.729 -13.390 -0.796 1.00 4.32 C ATOM 646 CD GLU A 38 -8.019 -14.114 -1.207 1.00 63.41 C ATOM 647 OE1 GLU A 38 -8.471 -13.940 -2.359 1.00 75.12 O ATOM 648 OE2 GLU A 38 -8.572 -14.879 -0.381 1.00 71.11 O ATOM 0 H GLU A 38 -3.134 -15.260 -1.305 1.00 2.43 H new ATOM 0 HA GLU A 38 -4.132 -12.484 -0.961 1.00 44.11 H new ATOM 0 HB2 GLU A 38 -5.419 -14.217 -2.284 1.00 62.42 H new ATOM 0 HB3 GLU A 38 -5.541 -15.180 -0.825 1.00 62.42 H new ATOM 0 HG2 GLU A 38 -6.730 -13.239 0.284 1.00 4.32 H new ATOM 0 HG3 GLU A 38 -6.710 -12.402 -1.256 1.00 4.32 H new ATOM 655 N ARG A 39 -4.460 -12.526 1.533 1.00 2.42 N ATOM 656 CA ARG A 39 -4.191 -12.330 2.966 1.00 64.15 C ATOM 657 C ARG A 39 -5.211 -11.357 3.607 1.00 34.04 C ATOM 658 O ARG A 39 -5.877 -10.591 2.912 1.00 54.24 O ATOM 659 CB ARG A 39 -2.744 -11.785 3.102 1.00 43.43 C ATOM 660 CG ARG A 39 -2.208 -11.713 4.532 1.00 32.32 C ATOM 661 CD ARG A 39 -0.857 -11.027 4.616 1.00 4.12 C ATOM 662 NE ARG A 39 0.191 -11.717 3.853 1.00 3.54 N ATOM 663 CZ ARG A 39 1.098 -12.549 4.389 1.00 63.02 C ATOM 664 NH1 ARG A 39 1.087 -12.818 5.681 1.00 21.05 N ATOM 665 NH2 ARG A 39 2.023 -13.091 3.628 1.00 22.25 N ATOM 0 H ARG A 39 -4.985 -11.763 1.105 1.00 2.42 H new ATOM 0 HA ARG A 39 -4.293 -13.278 3.495 1.00 64.15 H new ATOM 0 HB2 ARG A 39 -2.078 -12.416 2.513 1.00 43.43 H new ATOM 0 HB3 ARG A 39 -2.706 -10.787 2.666 1.00 43.43 H new ATOM 0 HG2 ARG A 39 -2.923 -11.178 5.157 1.00 32.32 H new ATOM 0 HG3 ARG A 39 -2.125 -12.722 4.936 1.00 32.32 H new ATOM 0 HD2 ARG A 39 -0.952 -10.005 4.248 1.00 4.12 H new ATOM 0 HD3 ARG A 39 -0.554 -10.963 5.661 1.00 4.12 H new ATOM 0 HE ARG A 39 0.233 -11.553 2.847 1.00 3.54 H new ATOM 0 HH11 ARG A 39 0.384 -12.392 6.285 1.00 21.05 H new ATOM 0 HH12 ARG A 39 1.782 -13.452 6.076 1.00 21.05 H new ATOM 0 HH21 ARG A 39 2.051 -12.879 2.631 1.00 22.25 H new ATOM 0 HH22 ARG A 39 2.712 -13.723 4.035 1.00 22.25 H new ATOM 679 N LEU A 40 -5.312 -11.398 4.949 1.00 62.41 N ATOM 680 CA LEU A 40 -6.096 -10.437 5.750 1.00 53.02 C ATOM 681 C LEU A 40 -5.172 -9.304 6.234 1.00 14.23 C ATOM 682 O LEU A 40 -4.189 -9.555 6.934 1.00 14.42 O ATOM 683 CB LEU A 40 -6.753 -11.157 6.968 1.00 11.53 C ATOM 684 CG LEU A 40 -7.497 -10.243 8.004 1.00 73.01 C ATOM 685 CD1 LEU A 40 -8.657 -9.446 7.359 1.00 21.33 C ATOM 686 CD2 LEU A 40 -7.977 -11.061 9.229 1.00 51.45 C ATOM 0 H LEU A 40 -4.846 -12.108 5.515 1.00 62.41 H new ATOM 0 HA LEU A 40 -6.889 -10.016 5.132 1.00 53.02 H new ATOM 0 HB2 LEU A 40 -7.464 -11.890 6.588 1.00 11.53 H new ATOM 0 HB3 LEU A 40 -5.977 -11.710 7.497 1.00 11.53 H new ATOM 0 HG LEU A 40 -6.775 -9.507 8.357 1.00 73.01 H new ATOM 0 HD11 LEU A 40 -9.140 -8.829 8.117 1.00 21.33 H new ATOM 0 HD12 LEU A 40 -8.264 -8.808 6.568 1.00 21.33 H new ATOM 0 HD13 LEU A 40 -9.385 -10.139 6.938 1.00 21.33 H new ATOM 0 HD21 LEU A 40 -8.489 -10.401 9.929 1.00 51.45 H new ATOM 0 HD22 LEU A 40 -8.662 -11.842 8.899 1.00 51.45 H new ATOM 0 HD23 LEU A 40 -7.118 -11.517 9.722 1.00 51.45 H new ATOM 698 N PHE A 41 -5.479 -8.069 5.818 1.00 3.33 N ATOM 699 CA PHE A 41 -4.797 -6.844 6.279 1.00 61.43 C ATOM 700 C PHE A 41 -5.740 -6.059 7.203 1.00 70.40 C ATOM 701 O PHE A 41 -6.849 -5.691 6.799 1.00 43.53 O ATOM 702 CB PHE A 41 -4.377 -5.963 5.070 1.00 74.34 C ATOM 703 CG PHE A 41 -3.231 -6.539 4.233 1.00 31.52 C ATOM 704 CD1 PHE A 41 -3.450 -7.571 3.318 1.00 70.22 C ATOM 705 CD2 PHE A 41 -1.930 -6.048 4.368 1.00 43.40 C ATOM 706 CE1 PHE A 41 -2.410 -8.086 2.566 1.00 0.21 C ATOM 707 CE2 PHE A 41 -0.892 -6.568 3.617 1.00 41.54 C ATOM 708 CZ PHE A 41 -1.133 -7.585 2.718 1.00 61.34 C ATOM 0 H PHE A 41 -6.219 -7.885 5.141 1.00 3.33 H new ATOM 0 HA PHE A 41 -3.896 -7.121 6.826 1.00 61.43 H new ATOM 0 HB2 PHE A 41 -5.243 -5.816 4.425 1.00 74.34 H new ATOM 0 HB3 PHE A 41 -4.083 -4.980 5.438 1.00 74.34 H new ATOM 0 HD1 PHE A 41 -4.445 -7.972 3.196 1.00 70.22 H new ATOM 0 HD2 PHE A 41 -1.732 -5.251 5.069 1.00 43.40 H new ATOM 0 HE1 PHE A 41 -2.597 -8.881 1.859 1.00 0.21 H new ATOM 0 HE2 PHE A 41 0.108 -6.177 3.735 1.00 41.54 H new ATOM 0 HZ PHE A 41 -0.321 -7.990 2.132 1.00 61.34 H new ATOM 718 N VAL A 42 -5.298 -5.841 8.446 1.00 51.44 N ATOM 719 CA VAL A 42 -6.014 -5.032 9.443 1.00 24.33 C ATOM 720 C VAL A 42 -5.183 -3.775 9.750 1.00 61.12 C ATOM 721 O VAL A 42 -4.020 -3.877 10.147 1.00 45.34 O ATOM 722 CB VAL A 42 -6.271 -5.825 10.784 1.00 43.53 C ATOM 723 CG1 VAL A 42 -7.098 -4.970 11.777 1.00 21.43 C ATOM 724 CG2 VAL A 42 -6.939 -7.200 10.517 1.00 52.44 C ATOM 0 H VAL A 42 -4.420 -6.226 8.795 1.00 51.44 H new ATOM 0 HA VAL A 42 -6.986 -4.768 9.026 1.00 24.33 H new ATOM 0 HB VAL A 42 -5.304 -6.028 11.243 1.00 43.53 H new ATOM 0 HG11 VAL A 42 -7.263 -5.536 12.694 1.00 21.43 H new ATOM 0 HG12 VAL A 42 -6.555 -4.054 12.009 1.00 21.43 H new ATOM 0 HG13 VAL A 42 -8.059 -4.718 11.328 1.00 21.43 H new ATOM 0 HG21 VAL A 42 -7.100 -7.716 11.463 1.00 52.44 H new ATOM 0 HG22 VAL A 42 -7.897 -7.049 10.019 1.00 52.44 H new ATOM 0 HG23 VAL A 42 -6.290 -7.802 9.881 1.00 52.44 H new ATOM 734 N LEU A 43 -5.793 -2.606 9.566 1.00 63.13 N ATOM 735 CA LEU A 43 -5.165 -1.304 9.824 1.00 12.40 C ATOM 736 C LEU A 43 -5.674 -0.751 11.153 1.00 23.52 C ATOM 737 O LEU A 43 -6.855 -0.432 11.288 1.00 20.11 O ATOM 738 CB LEU A 43 -5.494 -0.313 8.673 1.00 22.14 C ATOM 739 CG LEU A 43 -5.026 1.169 8.866 1.00 43.43 C ATOM 740 CD1 LEU A 43 -3.492 1.274 9.044 1.00 63.31 C ATOM 741 CD2 LEU A 43 -5.543 2.068 7.717 1.00 1.54 C ATOM 0 H LEU A 43 -6.753 -2.531 9.228 1.00 63.13 H new ATOM 0 HA LEU A 43 -4.083 -1.430 9.875 1.00 12.40 H new ATOM 0 HB2 LEU A 43 -5.045 -0.695 7.756 1.00 22.14 H new ATOM 0 HB3 LEU A 43 -6.574 -0.312 8.523 1.00 22.14 H new ATOM 0 HG LEU A 43 -5.468 1.536 9.792 1.00 43.43 H new ATOM 0 HD11 LEU A 43 -3.212 2.319 9.175 1.00 63.31 H new ATOM 0 HD12 LEU A 43 -3.188 0.704 9.922 1.00 63.31 H new ATOM 0 HD13 LEU A 43 -2.995 0.873 8.161 1.00 63.31 H new ATOM 0 HD21 LEU A 43 -5.204 3.092 7.875 1.00 1.54 H new ATOM 0 HD22 LEU A 43 -5.157 1.701 6.766 1.00 1.54 H new ATOM 0 HD23 LEU A 43 -6.633 2.045 7.699 1.00 1.54 H new ATOM 753 N THR A 44 -4.781 -0.683 12.140 1.00 22.12 N ATOM 754 CA THR A 44 -5.005 0.081 13.370 1.00 52.44 C ATOM 755 C THR A 44 -4.286 1.435 13.232 1.00 31.43 C ATOM 756 O THR A 44 -3.433 1.615 12.348 1.00 75.43 O ATOM 757 CB THR A 44 -4.501 -0.693 14.640 1.00 70.50 C ATOM 758 OG1 THR A 44 -3.080 -0.909 14.579 1.00 52.15 O ATOM 759 CG2 THR A 44 -5.218 -2.048 14.802 1.00 71.33 C ATOM 0 H THR A 44 -3.878 -1.157 12.110 1.00 22.12 H new ATOM 0 HA THR A 44 -6.075 0.234 13.507 1.00 52.44 H new ATOM 0 HB THR A 44 -4.735 -0.072 15.504 1.00 70.50 H new ATOM 0 HG1 THR A 44 -2.788 -0.905 13.643 1.00 52.15 H new ATOM 0 HG21 THR A 44 -4.843 -2.554 15.691 1.00 71.33 H new ATOM 0 HG22 THR A 44 -6.290 -1.882 14.904 1.00 71.33 H new ATOM 0 HG23 THR A 44 -5.028 -2.667 13.925 1.00 71.33 H new ATOM 767 N LYS A 45 -4.607 2.369 14.129 1.00 50.42 N ATOM 768 CA LYS A 45 -4.087 3.754 14.084 1.00 75.34 C ATOM 769 C LYS A 45 -2.616 3.857 14.559 1.00 72.21 C ATOM 770 O LYS A 45 -2.071 4.958 14.669 1.00 30.34 O ATOM 771 CB LYS A 45 -5.041 4.684 14.886 1.00 53.23 C ATOM 772 CG LYS A 45 -5.292 4.247 16.343 1.00 43.40 C ATOM 773 CD LYS A 45 -6.471 4.999 17.009 1.00 25.51 C ATOM 774 CE LYS A 45 -6.698 4.569 18.470 1.00 4.03 C ATOM 775 NZ LYS A 45 -5.596 5.017 19.363 1.00 35.32 N ATOM 0 H LYS A 45 -5.236 2.195 14.913 1.00 50.42 H new ATOM 0 HA LYS A 45 -4.068 4.084 13.045 1.00 75.34 H new ATOM 0 HB2 LYS A 45 -4.626 5.692 14.890 1.00 53.23 H new ATOM 0 HB3 LYS A 45 -5.998 4.735 14.366 1.00 53.23 H new ATOM 0 HG2 LYS A 45 -5.493 3.176 16.365 1.00 43.40 H new ATOM 0 HG3 LYS A 45 -4.387 4.413 16.927 1.00 43.40 H new ATOM 0 HD2 LYS A 45 -6.278 6.071 16.976 1.00 25.51 H new ATOM 0 HD3 LYS A 45 -7.381 4.821 16.436 1.00 25.51 H new ATOM 0 HE2 LYS A 45 -7.642 4.981 18.826 1.00 4.03 H new ATOM 0 HE3 LYS A 45 -6.785 3.484 18.519 1.00 4.03 H new ATOM 0 HZ1 LYS A 45 -5.806 4.736 20.342 1.00 35.32 H new ATOM 0 HZ2 LYS A 45 -4.703 4.577 19.060 1.00 35.32 H new ATOM 0 HZ3 LYS A 45 -5.507 6.052 19.312 1.00 35.32 H new ATOM 789 N SER A 46 -1.982 2.703 14.852 1.00 40.44 N ATOM 790 CA SER A 46 -0.544 2.634 15.190 1.00 40.32 C ATOM 791 C SER A 46 0.228 1.742 14.192 1.00 14.25 C ATOM 792 O SER A 46 1.372 2.054 13.827 1.00 2.02 O ATOM 793 CB SER A 46 -0.375 2.104 16.633 1.00 30.40 C ATOM 794 OG SER A 46 -1.085 2.914 17.562 1.00 74.01 O ATOM 0 H SER A 46 -2.449 1.796 14.861 1.00 40.44 H new ATOM 0 HA SER A 46 -0.126 3.638 15.123 1.00 40.32 H new ATOM 0 HB2 SER A 46 -0.736 1.077 16.691 1.00 30.40 H new ATOM 0 HB3 SER A 46 0.683 2.086 16.896 1.00 30.40 H new ATOM 0 HG SER A 46 -0.964 2.557 18.467 1.00 74.01 H new ATOM 800 N MET A 47 -0.407 0.635 13.729 1.00 13.52 N ATOM 801 CA MET A 47 0.261 -0.390 12.879 1.00 40.44 C ATOM 802 C MET A 47 -0.723 -0.992 11.858 1.00 54.42 C ATOM 803 O MET A 47 -1.904 -1.170 12.149 1.00 31.05 O ATOM 804 CB MET A 47 0.851 -1.549 13.751 1.00 61.41 C ATOM 805 CG MET A 47 1.993 -1.157 14.703 1.00 74.11 C ATOM 806 SD MET A 47 2.494 -2.508 15.796 1.00 53.11 S ATOM 807 CE MET A 47 1.009 -2.780 16.761 1.00 74.15 C ATOM 0 H MET A 47 -1.385 0.427 13.930 1.00 13.52 H new ATOM 0 HA MET A 47 1.070 0.114 12.350 1.00 40.44 H new ATOM 0 HB2 MET A 47 0.043 -1.981 14.342 1.00 61.41 H new ATOM 0 HB3 MET A 47 1.212 -2.332 13.084 1.00 61.41 H new ATOM 0 HG2 MET A 47 2.853 -0.833 14.117 1.00 74.11 H new ATOM 0 HG3 MET A 47 1.680 -0.305 15.307 1.00 74.11 H new ATOM 0 HE1 MET A 47 1.261 -3.323 17.672 1.00 74.15 H new ATOM 0 HE2 MET A 47 0.564 -1.820 17.023 1.00 74.15 H new ATOM 0 HE3 MET A 47 0.297 -3.362 16.176 1.00 74.15 H new ATOM 817 N LEU A 48 -0.213 -1.306 10.663 1.00 22.33 N ATOM 818 CA LEU A 48 -0.921 -2.124 9.667 1.00 70.11 C ATOM 819 C LEU A 48 -0.413 -3.570 9.800 1.00 3.45 C ATOM 820 O LEU A 48 0.656 -3.923 9.293 1.00 54.34 O ATOM 821 CB LEU A 48 -0.658 -1.553 8.239 1.00 14.24 C ATOM 822 CG LEU A 48 -1.200 -2.394 7.031 1.00 62.34 C ATOM 823 CD1 LEU A 48 -2.733 -2.567 7.085 1.00 44.21 C ATOM 824 CD2 LEU A 48 -0.738 -1.790 5.681 1.00 32.14 C ATOM 0 H LEU A 48 0.710 -0.998 10.355 1.00 22.33 H new ATOM 0 HA LEU A 48 -1.998 -2.105 9.833 1.00 70.11 H new ATOM 0 HB2 LEU A 48 -1.098 -0.557 8.185 1.00 14.24 H new ATOM 0 HB3 LEU A 48 0.418 -1.433 8.114 1.00 14.24 H new ATOM 0 HG LEU A 48 -0.771 -3.393 7.112 1.00 62.34 H new ATOM 0 HD11 LEU A 48 -3.063 -3.156 6.229 1.00 44.21 H new ATOM 0 HD12 LEU A 48 -3.009 -3.080 8.006 1.00 44.21 H new ATOM 0 HD13 LEU A 48 -3.211 -1.588 7.058 1.00 44.21 H new ATOM 0 HD21 LEU A 48 -1.128 -2.392 4.860 1.00 32.14 H new ATOM 0 HD22 LEU A 48 -1.112 -0.770 5.592 1.00 32.14 H new ATOM 0 HD23 LEU A 48 0.351 -1.782 5.640 1.00 32.14 H new ATOM 836 N THR A 49 -1.188 -4.394 10.511 1.00 44.04 N ATOM 837 CA THR A 49 -0.826 -5.785 10.824 1.00 50.54 C ATOM 838 C THR A 49 -1.548 -6.729 9.858 1.00 30.44 C ATOM 839 O THR A 49 -2.711 -6.499 9.528 1.00 44.01 O ATOM 840 CB THR A 49 -1.201 -6.130 12.308 1.00 14.34 C ATOM 841 OG1 THR A 49 -0.718 -5.089 13.180 1.00 70.25 O ATOM 842 CG2 THR A 49 -0.600 -7.478 12.756 1.00 40.12 C ATOM 0 H THR A 49 -2.093 -4.115 10.890 1.00 44.04 H new ATOM 0 HA THR A 49 0.251 -5.908 10.709 1.00 50.54 H new ATOM 0 HB THR A 49 -2.287 -6.207 12.365 1.00 14.34 H new ATOM 0 HG1 THR A 49 -0.954 -5.303 14.107 1.00 70.25 H new ATOM 0 HG21 THR A 49 -0.884 -7.678 13.789 1.00 40.12 H new ATOM 0 HG22 THR A 49 -0.977 -8.275 12.115 1.00 40.12 H new ATOM 0 HG23 THR A 49 0.487 -7.435 12.681 1.00 40.12 H new ATOM 850 N TYR A 50 -0.868 -7.795 9.412 1.00 2.43 N ATOM 851 CA TYR A 50 -1.410 -8.697 8.386 1.00 10.53 C ATOM 852 C TYR A 50 -1.173 -10.177 8.743 1.00 61.12 C ATOM 853 O TYR A 50 -0.061 -10.577 9.092 1.00 53.21 O ATOM 854 CB TYR A 50 -0.832 -8.326 6.995 1.00 73.43 C ATOM 855 CG TYR A 50 0.705 -8.195 6.905 1.00 3.23 C ATOM 856 CD1 TYR A 50 1.344 -6.970 7.144 1.00 33.25 C ATOM 857 CD2 TYR A 50 1.518 -9.281 6.552 1.00 24.34 C ATOM 858 CE1 TYR A 50 2.718 -6.843 7.043 1.00 11.52 C ATOM 859 CE2 TYR A 50 2.890 -9.152 6.447 1.00 51.42 C ATOM 860 CZ TYR A 50 3.483 -7.933 6.693 1.00 51.22 C ATOM 861 OH TYR A 50 4.851 -7.805 6.584 1.00 54.31 O ATOM 0 H TYR A 50 0.060 -8.054 9.747 1.00 2.43 H new ATOM 0 HA TYR A 50 -2.491 -8.567 8.346 1.00 10.53 H new ATOM 0 HB2 TYR A 50 -1.153 -9.082 6.278 1.00 73.43 H new ATOM 0 HB3 TYR A 50 -1.275 -7.381 6.682 1.00 73.43 H new ATOM 0 HD1 TYR A 50 0.751 -6.108 7.412 1.00 33.25 H new ATOM 0 HD2 TYR A 50 1.062 -10.240 6.358 1.00 24.34 H new ATOM 0 HE1 TYR A 50 3.189 -5.891 7.238 1.00 11.52 H new ATOM 0 HE2 TYR A 50 3.495 -10.004 6.173 1.00 51.42 H new ATOM 0 HH TYR A 50 5.241 -8.667 6.330 1.00 54.31 H new ATOM 871 N TYR A 51 -2.269 -10.960 8.666 1.00 35.32 N ATOM 872 CA TYR A 51 -2.304 -12.407 8.965 1.00 24.11 C ATOM 873 C TYR A 51 -2.801 -13.167 7.734 1.00 21.03 C ATOM 874 O TYR A 51 -3.772 -12.736 7.106 1.00 13.11 O ATOM 875 CB TYR A 51 -3.289 -12.692 10.137 1.00 64.35 C ATOM 876 CG TYR A 51 -3.180 -11.736 11.331 1.00 43.53 C ATOM 877 CD1 TYR A 51 -3.902 -10.534 11.353 1.00 52.03 C ATOM 878 CD2 TYR A 51 -2.373 -12.030 12.431 1.00 50.40 C ATOM 879 CE1 TYR A 51 -3.819 -9.669 12.423 1.00 43.32 C ATOM 880 CE2 TYR A 51 -2.292 -11.163 13.503 1.00 50.14 C ATOM 881 CZ TYR A 51 -3.016 -9.988 13.494 1.00 14.31 C ATOM 882 OH TYR A 51 -2.935 -9.123 14.566 1.00 14.14 O ATOM 0 H TYR A 51 -3.179 -10.593 8.387 1.00 35.32 H new ATOM 0 HA TYR A 51 -1.299 -12.729 9.239 1.00 24.11 H new ATOM 0 HB2 TYR A 51 -4.308 -12.651 9.752 1.00 64.35 H new ATOM 0 HB3 TYR A 51 -3.122 -13.709 10.491 1.00 64.35 H new ATOM 0 HD1 TYR A 51 -4.535 -10.281 10.515 1.00 52.03 H new ATOM 0 HD2 TYR A 51 -1.804 -12.948 12.444 1.00 50.40 H new ATOM 0 HE1 TYR A 51 -4.381 -8.747 12.421 1.00 43.32 H new ATOM 0 HE2 TYR A 51 -1.663 -11.404 14.347 1.00 50.14 H new ATOM 0 HH TYR A 51 -2.328 -9.493 15.240 1.00 14.14 H new ATOM 1081 N PHE A 63 3.773 -7.156 10.561 1.00 23.54 N ATOM 1082 CA PHE A 63 3.129 -5.839 10.650 1.00 33.32 C ATOM 1083 C PHE A 63 4.078 -4.763 10.130 1.00 0.25 C ATOM 1084 O PHE A 63 5.296 -4.975 10.035 1.00 62.43 O ATOM 1085 CB PHE A 63 2.655 -5.509 12.095 1.00 40.53 C ATOM 1086 CG PHE A 63 3.757 -5.358 13.147 1.00 53.05 C ATOM 1087 CD1 PHE A 63 4.294 -6.471 13.796 1.00 20.51 C ATOM 1088 CD2 PHE A 63 4.245 -4.095 13.505 1.00 24.34 C ATOM 1089 CE1 PHE A 63 5.278 -6.326 14.763 1.00 34.35 C ATOM 1090 CE2 PHE A 63 5.226 -3.956 14.469 1.00 21.22 C ATOM 1091 CZ PHE A 63 5.742 -5.070 15.098 1.00 3.41 C ATOM 0 HA PHE A 63 2.235 -5.863 10.027 1.00 33.32 H new ATOM 0 HB2 PHE A 63 2.080 -4.583 12.065 1.00 40.53 H new ATOM 0 HB3 PHE A 63 1.975 -6.296 12.421 1.00 40.53 H new ATOM 0 HD1 PHE A 63 3.939 -7.459 13.542 1.00 20.51 H new ATOM 0 HD2 PHE A 63 3.848 -3.215 13.020 1.00 24.34 H new ATOM 0 HE1 PHE A 63 5.682 -7.198 15.255 1.00 34.35 H new ATOM 0 HE2 PHE A 63 5.589 -2.973 14.730 1.00 21.22 H new ATOM 0 HZ PHE A 63 6.508 -4.960 15.851 1.00 3.41 H new ATOM 1101 N ILE A 64 3.502 -3.617 9.786 1.00 53.44 N ATOM 1102 CA ILE A 64 4.232 -2.429 9.364 1.00 62.24 C ATOM 1103 C ILE A 64 3.806 -1.273 10.273 1.00 31.31 C ATOM 1104 O ILE A 64 2.616 -0.981 10.383 1.00 50.14 O ATOM 1105 CB ILE A 64 3.938 -2.062 7.858 1.00 10.24 C ATOM 1106 CG1 ILE A 64 4.254 -3.266 6.911 1.00 21.35 C ATOM 1107 CG2 ILE A 64 4.736 -0.807 7.443 1.00 24.44 C ATOM 1108 CD1 ILE A 64 3.922 -3.032 5.448 1.00 52.54 C ATOM 0 H ILE A 64 2.491 -3.486 9.793 1.00 53.44 H new ATOM 0 HA ILE A 64 5.302 -2.620 9.443 1.00 62.24 H new ATOM 0 HB ILE A 64 2.875 -1.839 7.764 1.00 10.24 H new ATOM 0 HG12 ILE A 64 5.314 -3.507 6.994 1.00 21.35 H new ATOM 0 HG13 ILE A 64 3.701 -4.138 7.259 1.00 21.35 H new ATOM 0 HG21 ILE A 64 4.522 -0.568 6.401 1.00 24.44 H new ATOM 0 HG22 ILE A 64 4.448 0.033 8.075 1.00 24.44 H new ATOM 0 HG23 ILE A 64 5.803 -0.999 7.559 1.00 24.44 H new ATOM 0 HD11 ILE A 64 4.175 -3.921 4.871 1.00 52.54 H new ATOM 0 HD12 ILE A 64 2.857 -2.824 5.345 1.00 52.54 H new ATOM 0 HD13 ILE A 64 4.495 -2.183 5.076 1.00 52.54 H new ATOM 1120 N ASP A 65 4.778 -0.630 10.924 1.00 11.43 N ATOM 1121 CA ASP A 65 4.523 0.539 11.780 1.00 45.24 C ATOM 1122 C ASP A 65 4.141 1.732 10.897 1.00 42.41 C ATOM 1123 O ASP A 65 4.828 2.004 9.910 1.00 33.52 O ATOM 1124 CB ASP A 65 5.780 0.873 12.620 1.00 21.23 C ATOM 1125 CG ASP A 65 6.092 -0.205 13.666 1.00 32.44 C ATOM 1126 OD1 ASP A 65 5.575 -0.117 14.807 1.00 70.13 O ATOM 1127 OD2 ASP A 65 6.844 -1.149 13.351 1.00 12.30 O ATOM 0 H ASP A 65 5.760 -0.900 10.876 1.00 11.43 H new ATOM 0 HA ASP A 65 3.704 0.317 12.465 1.00 45.24 H new ATOM 0 HB2 ASP A 65 6.636 0.989 11.956 1.00 21.23 H new ATOM 0 HB3 ASP A 65 5.634 1.830 13.122 1.00 21.23 H new ATOM 1132 N VAL A 66 3.044 2.423 11.250 1.00 14.32 N ATOM 1133 CA VAL A 66 2.625 3.671 10.573 1.00 23.13 C ATOM 1134 C VAL A 66 3.646 4.800 10.883 1.00 2.22 C ATOM 1135 O VAL A 66 3.816 5.750 10.108 1.00 73.32 O ATOM 1136 CB VAL A 66 1.141 4.065 10.963 1.00 22.41 C ATOM 1137 CG1 VAL A 66 0.657 5.336 10.222 1.00 12.22 C ATOM 1138 CG2 VAL A 66 0.172 2.875 10.697 1.00 62.42 C ATOM 0 H VAL A 66 2.423 2.138 12.007 1.00 14.32 H new ATOM 0 HA VAL A 66 2.621 3.513 9.495 1.00 23.13 H new ATOM 0 HB VAL A 66 1.138 4.294 12.029 1.00 22.41 H new ATOM 0 HG11 VAL A 66 -0.365 5.565 10.523 1.00 12.22 H new ATOM 0 HG12 VAL A 66 1.306 6.174 10.475 1.00 12.22 H new ATOM 0 HG13 VAL A 66 0.689 5.164 9.146 1.00 12.22 H new ATOM 0 HG21 VAL A 66 -0.843 3.164 10.971 1.00 62.42 H new ATOM 0 HG22 VAL A 66 0.201 2.611 9.640 1.00 62.42 H new ATOM 0 HG23 VAL A 66 0.478 2.016 11.294 1.00 62.42 H new ATOM 1148 N SER A 67 4.373 4.620 12.010 1.00 13.32 N ATOM 1149 CA SER A 67 5.544 5.439 12.391 1.00 21.12 C ATOM 1150 C SER A 67 6.717 5.265 11.385 1.00 14.15 C ATOM 1151 O SER A 67 7.594 6.133 11.283 1.00 14.33 O ATOM 1152 CB SER A 67 6.014 5.040 13.814 1.00 50.33 C ATOM 1153 OG SER A 67 4.948 5.107 14.750 1.00 72.12 O ATOM 0 H SER A 67 4.158 3.890 12.689 1.00 13.32 H new ATOM 0 HA SER A 67 5.243 6.486 12.376 1.00 21.12 H new ATOM 0 HB2 SER A 67 6.420 4.029 13.794 1.00 50.33 H new ATOM 0 HB3 SER A 67 6.821 5.701 14.131 1.00 50.33 H new ATOM 0 HG SER A 67 5.275 4.848 15.637 1.00 72.12 H new ATOM 1159 N LYS A 68 6.739 4.113 10.686 1.00 50.11 N ATOM 1160 CA LYS A 68 7.753 3.791 9.655 1.00 12.11 C ATOM 1161 C LYS A 68 7.218 3.931 8.207 1.00 61.43 C ATOM 1162 O LYS A 68 8.013 3.875 7.259 1.00 10.45 O ATOM 1163 CB LYS A 68 8.296 2.355 9.913 1.00 52.23 C ATOM 1164 CG LYS A 68 9.076 2.211 11.245 1.00 74.35 C ATOM 1165 CD LYS A 68 10.384 3.038 11.250 1.00 13.32 C ATOM 1166 CE LYS A 68 11.150 2.982 12.579 1.00 21.21 C ATOM 1167 NZ LYS A 68 12.449 3.716 12.497 1.00 33.24 N ATOM 0 H LYS A 68 6.050 3.373 10.820 1.00 50.11 H new ATOM 0 HA LYS A 68 8.559 4.519 9.741 1.00 12.11 H new ATOM 0 HB2 LYS A 68 7.460 1.655 9.915 1.00 52.23 H new ATOM 0 HB3 LYS A 68 8.949 2.070 9.088 1.00 52.23 H new ATOM 0 HG2 LYS A 68 8.442 2.532 12.072 1.00 74.35 H new ATOM 0 HG3 LYS A 68 9.312 1.160 11.414 1.00 74.35 H new ATOM 0 HD2 LYS A 68 11.033 2.677 10.452 1.00 13.32 H new ATOM 0 HD3 LYS A 68 10.146 4.077 11.022 1.00 13.32 H new ATOM 0 HE2 LYS A 68 10.537 3.413 13.371 1.00 21.21 H new ATOM 0 HE3 LYS A 68 11.335 1.942 12.849 1.00 21.21 H new ATOM 0 HZ1 LYS A 68 12.939 3.657 13.412 1.00 33.24 H new ATOM 0 HZ2 LYS A 68 13.043 3.289 11.758 1.00 33.24 H new ATOM 0 HZ3 LYS A 68 12.270 4.714 12.264 1.00 33.24 H new ATOM 1181 N ILE A 69 5.888 4.102 8.035 1.00 12.41 N ATOM 1182 CA ILE A 69 5.274 4.303 6.699 1.00 74.03 C ATOM 1183 C ILE A 69 5.497 5.751 6.226 1.00 33.02 C ATOM 1184 O ILE A 69 5.023 6.694 6.864 1.00 45.32 O ATOM 1185 CB ILE A 69 3.729 3.986 6.673 1.00 62.42 C ATOM 1186 CG1 ILE A 69 3.462 2.488 7.005 1.00 11.03 C ATOM 1187 CG2 ILE A 69 3.098 4.363 5.305 1.00 72.42 C ATOM 1188 CD1 ILE A 69 1.990 2.085 7.060 1.00 23.32 C ATOM 0 H ILE A 69 5.217 4.105 8.804 1.00 12.41 H new ATOM 0 HA ILE A 69 5.765 3.599 6.027 1.00 74.03 H new ATOM 0 HB ILE A 69 3.255 4.597 7.441 1.00 62.42 H new ATOM 0 HG12 ILE A 69 3.963 1.872 6.258 1.00 11.03 H new ATOM 0 HG13 ILE A 69 3.921 2.258 7.967 1.00 11.03 H new ATOM 0 HG21 ILE A 69 2.033 4.132 5.320 1.00 72.42 H new ATOM 0 HG22 ILE A 69 3.236 5.429 5.122 1.00 72.42 H new ATOM 0 HG23 ILE A 69 3.582 3.793 4.512 1.00 72.42 H new ATOM 0 HD11 ILE A 69 1.912 1.024 7.298 1.00 23.32 H new ATOM 0 HD12 ILE A 69 1.482 2.668 7.828 1.00 23.32 H new ATOM 0 HD13 ILE A 69 1.524 2.275 6.093 1.00 23.32 H new ATOM 1200 N LYS A 70 6.213 5.892 5.098 1.00 0.42 N ATOM 1201 CA LYS A 70 6.488 7.183 4.448 1.00 60.34 C ATOM 1202 C LYS A 70 5.259 7.635 3.645 1.00 15.45 C ATOM 1203 O LYS A 70 4.534 8.535 4.067 1.00 50.31 O ATOM 1204 CB LYS A 70 7.749 7.069 3.529 1.00 52.21 C ATOM 1205 CG LYS A 70 8.946 6.319 4.160 1.00 73.31 C ATOM 1206 CD LYS A 70 9.425 6.934 5.496 1.00 3.11 C ATOM 1207 CE LYS A 70 10.569 6.128 6.136 1.00 62.41 C ATOM 1208 NZ LYS A 70 11.783 6.109 5.277 1.00 34.22 N ATOM 0 H LYS A 70 6.623 5.099 4.605 1.00 0.42 H new ATOM 0 HA LYS A 70 6.695 7.933 5.212 1.00 60.34 H new ATOM 0 HB2 LYS A 70 7.465 6.561 2.608 1.00 52.21 H new ATOM 0 HB3 LYS A 70 8.072 8.073 3.253 1.00 52.21 H new ATOM 0 HG2 LYS A 70 8.665 5.279 4.328 1.00 73.31 H new ATOM 0 HG3 LYS A 70 9.776 6.315 3.453 1.00 73.31 H new ATOM 0 HD2 LYS A 70 9.758 7.957 5.323 1.00 3.11 H new ATOM 0 HD3 LYS A 70 8.587 6.984 6.191 1.00 3.11 H new ATOM 0 HE2 LYS A 70 10.818 6.558 7.106 1.00 62.41 H new ATOM 0 HE3 LYS A 70 10.236 5.106 6.316 1.00 62.41 H new ATOM 0 HZ1 LYS A 70 12.561 5.644 5.786 1.00 34.22 H new ATOM 0 HZ2 LYS A 70 11.581 5.585 4.401 1.00 34.22 H new ATOM 0 HZ3 LYS A 70 12.057 7.084 5.042 1.00 34.22 H new ATOM 1222 N CYS A 71 5.015 6.974 2.498 1.00 24.11 N ATOM 1223 CA CYS A 71 3.937 7.347 1.568 1.00 11.12 C ATOM 1224 C CYS A 71 3.151 6.111 1.108 1.00 65.10 C ATOM 1225 O CYS A 71 3.735 5.151 0.605 1.00 71.01 O ATOM 1226 CB CYS A 71 4.536 8.075 0.344 1.00 41.41 C ATOM 1227 SG CYS A 71 5.428 9.582 0.765 1.00 51.20 S ATOM 0 H CYS A 71 5.560 6.168 2.192 1.00 24.11 H new ATOM 0 HA CYS A 71 3.248 8.012 2.089 1.00 11.12 H new ATOM 0 HB2 CYS A 71 5.212 7.396 -0.177 1.00 41.41 H new ATOM 0 HB3 CYS A 71 3.733 8.320 -0.351 1.00 41.41 H new ATOM 0 HG CYS A 71 5.333 10.431 -0.215 1.00 51.20 H new ATOM 1233 N VAL A 72 1.826 6.140 1.314 1.00 50.32 N ATOM 1234 CA VAL A 72 0.895 5.189 0.698 1.00 32.33 C ATOM 1235 C VAL A 72 0.161 5.908 -0.428 1.00 42.11 C ATOM 1236 O VAL A 72 -0.530 6.915 -0.186 1.00 51.41 O ATOM 1237 CB VAL A 72 -0.159 4.606 1.706 1.00 23.32 C ATOM 1238 CG1 VAL A 72 -1.158 3.656 0.985 1.00 4.21 C ATOM 1239 CG2 VAL A 72 0.542 3.902 2.886 1.00 53.10 C ATOM 0 H VAL A 72 1.371 6.827 1.915 1.00 50.32 H new ATOM 0 HA VAL A 72 1.479 4.344 0.333 1.00 32.33 H new ATOM 0 HB VAL A 72 -0.736 5.437 2.112 1.00 23.32 H new ATOM 0 HG11 VAL A 72 -1.876 3.267 1.707 1.00 4.21 H new ATOM 0 HG12 VAL A 72 -1.687 4.207 0.207 1.00 4.21 H new ATOM 0 HG13 VAL A 72 -0.612 2.827 0.535 1.00 4.21 H new ATOM 0 HG21 VAL A 72 -0.208 3.506 3.571 1.00 53.10 H new ATOM 0 HG22 VAL A 72 1.156 3.084 2.509 1.00 53.10 H new ATOM 0 HG23 VAL A 72 1.173 4.617 3.413 1.00 53.10 H new ATOM 1249 N GLU A 73 0.314 5.397 -1.644 1.00 72.33 N ATOM 1250 CA GLU A 73 -0.350 5.936 -2.822 1.00 42.14 C ATOM 1251 C GLU A 73 -0.756 4.782 -3.733 1.00 64.12 C ATOM 1252 O GLU A 73 -0.288 3.656 -3.570 1.00 51.33 O ATOM 1253 CB GLU A 73 0.583 6.936 -3.567 1.00 44.42 C ATOM 1254 CG GLU A 73 -0.127 7.838 -4.594 1.00 52.03 C ATOM 1255 CD GLU A 73 -1.219 8.723 -3.977 1.00 1.40 C ATOM 1256 OE1 GLU A 73 -0.891 9.799 -3.441 1.00 61.13 O ATOM 1257 OE2 GLU A 73 -2.408 8.338 -4.004 1.00 12.34 O ATOM 0 H GLU A 73 0.907 4.591 -1.840 1.00 72.33 H new ATOM 0 HA GLU A 73 -1.243 6.484 -2.521 1.00 42.14 H new ATOM 0 HB2 GLU A 73 1.078 7.568 -2.830 1.00 44.42 H new ATOM 0 HB3 GLU A 73 1.363 6.372 -4.078 1.00 44.42 H new ATOM 0 HG2 GLU A 73 0.613 8.473 -5.081 1.00 52.03 H new ATOM 0 HG3 GLU A 73 -0.571 7.214 -5.369 1.00 52.03 H new ATOM 1264 N ILE A 74 -1.650 5.074 -4.670 1.00 2.33 N ATOM 1265 CA ILE A 74 -2.036 4.152 -5.741 1.00 13.13 C ATOM 1266 C ILE A 74 -0.833 3.799 -6.655 1.00 25.13 C ATOM 1267 O ILE A 74 0.194 4.492 -6.650 1.00 63.13 O ATOM 1268 CB ILE A 74 -3.257 4.766 -6.552 1.00 41.11 C ATOM 1269 CG1 ILE A 74 -3.015 6.254 -7.021 1.00 1.44 C ATOM 1270 CG2 ILE A 74 -4.543 4.708 -5.684 1.00 21.43 C ATOM 1271 CD1 ILE A 74 -2.008 6.481 -8.138 1.00 4.41 C ATOM 0 H ILE A 74 -2.136 5.970 -4.711 1.00 2.33 H new ATOM 0 HA ILE A 74 -2.360 3.209 -5.300 1.00 13.13 H new ATOM 0 HB ILE A 74 -3.366 4.161 -7.452 1.00 41.11 H new ATOM 0 HG12 ILE A 74 -3.972 6.666 -7.341 1.00 1.44 H new ATOM 0 HG13 ILE A 74 -2.693 6.832 -6.155 1.00 1.44 H new ATOM 0 HG21 ILE A 74 -5.378 5.130 -6.243 1.00 21.43 H new ATOM 0 HG22 ILE A 74 -4.763 3.671 -5.429 1.00 21.43 H new ATOM 0 HG23 ILE A 74 -4.391 5.282 -4.770 1.00 21.43 H new ATOM 0 HD11 ILE A 74 -1.942 7.547 -8.358 1.00 4.41 H new ATOM 0 HD12 ILE A 74 -1.030 6.114 -7.826 1.00 4.41 H new ATOM 0 HD13 ILE A 74 -2.329 5.945 -9.031 1.00 4.41 H new ATOM 1283 N VAL A 75 -0.964 2.709 -7.424 1.00 61.32 N ATOM 1284 CA VAL A 75 0.019 2.310 -8.452 1.00 3.41 C ATOM 1285 C VAL A 75 -0.756 2.174 -9.765 1.00 41.31 C ATOM 1286 O VAL A 75 -1.540 1.227 -9.924 1.00 42.02 O ATOM 1287 CB VAL A 75 0.759 0.955 -8.114 1.00 1.33 C ATOM 1288 CG1 VAL A 75 1.816 0.611 -9.191 1.00 12.34 C ATOM 1289 CG2 VAL A 75 1.393 0.992 -6.708 1.00 10.43 C ATOM 0 H VAL A 75 -1.758 2.073 -7.353 1.00 61.32 H new ATOM 0 HA VAL A 75 0.804 3.064 -8.510 1.00 3.41 H new ATOM 0 HB VAL A 75 0.009 0.164 -8.116 1.00 1.33 H new ATOM 0 HG11 VAL A 75 2.308 -0.326 -8.931 1.00 12.34 H new ATOM 0 HG12 VAL A 75 1.328 0.508 -10.160 1.00 12.34 H new ATOM 0 HG13 VAL A 75 2.557 1.409 -9.241 1.00 12.34 H new ATOM 0 HG21 VAL A 75 1.893 0.044 -6.509 1.00 10.43 H new ATOM 0 HG22 VAL A 75 2.119 1.803 -6.658 1.00 10.43 H new ATOM 0 HG23 VAL A 75 0.615 1.155 -5.962 1.00 10.43 H new ATOM 1299 N LYS A 76 -0.572 3.146 -10.672 1.00 73.24 N ATOM 1300 CA LYS A 76 -1.365 3.252 -11.901 1.00 72.23 C ATOM 1301 C LYS A 76 -0.992 2.149 -12.892 1.00 12.13 C ATOM 1302 O LYS A 76 0.110 2.137 -13.452 1.00 45.20 O ATOM 1303 CB LYS A 76 -1.206 4.653 -12.543 1.00 34.13 C ATOM 1304 CG LYS A 76 -1.683 5.800 -11.623 1.00 12.33 C ATOM 1305 CD LYS A 76 -1.709 7.206 -12.279 1.00 75.44 C ATOM 1306 CE LYS A 76 -2.873 7.421 -13.268 1.00 31.43 C ATOM 1307 NZ LYS A 76 -2.728 6.650 -14.534 1.00 61.32 N ATOM 0 H LYS A 76 0.131 3.879 -10.572 1.00 73.24 H new ATOM 0 HA LYS A 76 -2.414 3.121 -11.636 1.00 72.23 H new ATOM 0 HB2 LYS A 76 -0.158 4.812 -12.798 1.00 34.13 H new ATOM 0 HB3 LYS A 76 -1.770 4.685 -13.475 1.00 34.13 H new ATOM 0 HG2 LYS A 76 -2.686 5.565 -11.266 1.00 12.33 H new ATOM 0 HG3 LYS A 76 -1.034 5.837 -10.748 1.00 12.33 H new ATOM 0 HD2 LYS A 76 -1.770 7.960 -11.494 1.00 75.44 H new ATOM 0 HD3 LYS A 76 -0.767 7.367 -12.803 1.00 75.44 H new ATOM 0 HE2 LYS A 76 -3.807 7.137 -12.784 1.00 31.43 H new ATOM 0 HE3 LYS A 76 -2.947 8.482 -13.505 1.00 31.43 H new ATOM 0 HZ1 LYS A 76 -3.098 7.212 -15.327 1.00 61.32 H new ATOM 0 HZ2 LYS A 76 -1.723 6.438 -14.698 1.00 61.32 H new ATOM 0 HZ3 LYS A 76 -3.262 5.760 -14.462 1.00 61.32 H new ATOM 1382 N ILE A 82 -2.667 -6.948 -15.630 1.00 61.15 N ATOM 1383 CA ILE A 82 -2.023 -7.458 -14.406 1.00 24.44 C ATOM 1384 C ILE A 82 -2.280 -8.989 -14.321 1.00 64.25 C ATOM 1385 O ILE A 82 -3.436 -9.411 -14.400 1.00 35.44 O ATOM 1386 CB ILE A 82 -2.592 -6.744 -13.112 1.00 21.15 C ATOM 1387 CG1 ILE A 82 -2.314 -5.209 -13.139 1.00 5.24 C ATOM 1388 CG2 ILE A 82 -2.038 -7.369 -11.807 1.00 13.22 C ATOM 1389 CD1 ILE A 82 -0.851 -4.799 -12.983 1.00 0.42 C ATOM 0 HA ILE A 82 -0.954 -7.249 -14.452 1.00 24.44 H new ATOM 0 HB ILE A 82 -3.671 -6.900 -13.121 1.00 21.15 H new ATOM 0 HG12 ILE A 82 -2.686 -4.807 -14.081 1.00 5.24 H new ATOM 0 HG13 ILE A 82 -2.891 -4.740 -12.342 1.00 5.24 H new ATOM 0 HG21 ILE A 82 -2.457 -6.846 -10.947 1.00 13.22 H new ATOM 0 HG22 ILE A 82 -2.315 -8.422 -11.762 1.00 13.22 H new ATOM 0 HG23 ILE A 82 -0.952 -7.279 -11.793 1.00 13.22 H new ATOM 0 HD11 ILE A 82 -0.772 -3.712 -13.016 1.00 0.42 H new ATOM 0 HD12 ILE A 82 -0.471 -5.162 -12.028 1.00 0.42 H new ATOM 0 HD13 ILE A 82 -0.264 -5.230 -13.794 1.00 0.42 H new ATOM 1401 N PRO A 83 -1.218 -9.845 -14.154 1.00 41.24 N ATOM 1402 CA PRO A 83 -1.373 -11.328 -14.047 1.00 45.12 C ATOM 1403 C PRO A 83 -1.818 -11.816 -12.637 1.00 11.32 C ATOM 1404 O PRO A 83 -1.556 -12.961 -12.251 1.00 54.40 O ATOM 1405 CB PRO A 83 0.043 -11.833 -14.415 1.00 45.24 C ATOM 1406 CG PRO A 83 0.971 -10.756 -13.940 1.00 33.21 C ATOM 1407 CD PRO A 83 0.220 -9.445 -14.087 1.00 71.22 C ATOM 0 HA PRO A 83 -2.165 -11.709 -14.692 1.00 45.12 H new ATOM 0 HB2 PRO A 83 0.261 -12.785 -13.931 1.00 45.24 H new ATOM 0 HB3 PRO A 83 0.139 -11.992 -15.489 1.00 45.24 H new ATOM 0 HG2 PRO A 83 1.261 -10.923 -12.903 1.00 33.21 H new ATOM 0 HG3 PRO A 83 1.888 -10.746 -14.529 1.00 33.21 H new ATOM 0 HD2 PRO A 83 0.409 -8.782 -13.243 1.00 71.22 H new ATOM 0 HD3 PRO A 83 0.526 -8.911 -14.986 1.00 71.22 H new ATOM 1415 N CYS A 84 -2.521 -10.943 -11.899 1.00 15.21 N ATOM 1416 CA CYS A 84 -3.100 -11.248 -10.575 1.00 44.13 C ATOM 1417 C CYS A 84 -4.629 -11.280 -10.692 1.00 23.32 C ATOM 1418 O CYS A 84 -5.195 -10.627 -11.578 1.00 71.53 O ATOM 1419 CB CYS A 84 -2.674 -10.166 -9.557 1.00 22.45 C ATOM 1420 SG CYS A 84 -3.264 -10.424 -7.870 1.00 25.12 S ATOM 0 H CYS A 84 -2.708 -9.989 -12.208 1.00 15.21 H new ATOM 0 HA CYS A 84 -2.740 -12.218 -10.231 1.00 44.13 H new ATOM 0 HB2 CYS A 84 -1.585 -10.114 -9.540 1.00 22.45 H new ATOM 0 HB3 CYS A 84 -3.034 -9.199 -9.907 1.00 22.45 H new ATOM 0 HG CYS A 84 -2.843 -9.457 -7.110 1.00 25.12 H new ATOM 1426 N GLN A 85 -5.298 -12.027 -9.795 1.00 3.15 N ATOM 1427 CA GLN A 85 -6.779 -12.042 -9.718 1.00 23.50 C ATOM 1428 C GLN A 85 -7.306 -10.690 -9.171 1.00 11.33 C ATOM 1429 O GLN A 85 -8.472 -10.338 -9.375 1.00 71.41 O ATOM 1430 CB GLN A 85 -7.289 -13.231 -8.847 1.00 73.31 C ATOM 1431 CG GLN A 85 -6.857 -13.170 -7.369 1.00 4.03 C ATOM 1432 CD GLN A 85 -7.426 -14.288 -6.482 1.00 42.21 C ATOM 1433 OE1 GLN A 85 -6.707 -14.631 -5.422 1.00 73.03 O flip ATOM 1434 NE2 GLN A 85 -8.509 -14.819 -6.734 1.00 70.11 N flip ATOM 0 H GLN A 85 -4.841 -12.630 -9.111 1.00 3.15 H new ATOM 0 HA GLN A 85 -7.168 -12.182 -10.726 1.00 23.50 H new ATOM 0 HB2 GLN A 85 -8.378 -13.259 -8.894 1.00 73.31 H new ATOM 0 HB3 GLN A 85 -6.928 -14.164 -9.280 1.00 73.31 H new ATOM 0 HG2 GLN A 85 -5.769 -13.207 -7.322 1.00 4.03 H new ATOM 0 HG3 GLN A 85 -7.161 -12.208 -6.956 1.00 4.03 H new ATOM 0 HE21 GLN A 85 -9.038 -14.533 -7.558 1.00 70.11 H new ATOM 0 HE22 GLN A 85 -8.876 -15.545 -6.119 1.00 70.11 H new ATOM 1443 N ASN A 86 -6.424 -9.952 -8.472 1.00 62.52 N ATOM 1444 CA ASN A 86 -6.688 -8.588 -7.982 1.00 30.34 C ATOM 1445 C ASN A 86 -5.895 -7.575 -8.834 1.00 42.24 C ATOM 1446 O ASN A 86 -4.660 -7.613 -8.860 1.00 31.24 O ATOM 1447 CB ASN A 86 -6.271 -8.450 -6.490 1.00 0.44 C ATOM 1448 CG ASN A 86 -7.154 -9.213 -5.498 1.00 34.23 C ATOM 1449 OD1 ASN A 86 -7.773 -10.224 -5.827 1.00 33.42 O ATOM 1450 ND2 ASN A 86 -7.179 -8.751 -4.254 1.00 0.34 N ATOM 0 H ASN A 86 -5.494 -10.293 -8.228 1.00 62.52 H new ATOM 0 HA ASN A 86 -7.756 -8.387 -8.065 1.00 30.34 H new ATOM 0 HB2 ASN A 86 -5.244 -8.799 -6.382 1.00 0.44 H new ATOM 0 HB3 ASN A 86 -6.279 -7.393 -6.222 1.00 0.44 H new ATOM 0 HD21 ASN A 86 -7.722 -9.237 -3.540 1.00 0.34 H new ATOM 0 HD22 ASN A 86 -6.655 -7.910 -4.012 1.00 0.34 H new ATOM 1457 N LYS A 87 -6.617 -6.696 -9.541 1.00 13.24 N ATOM 1458 CA LYS A 87 -6.036 -5.538 -10.257 1.00 13.40 C ATOM 1459 C LYS A 87 -6.132 -4.290 -9.368 1.00 3.42 C ATOM 1460 O LYS A 87 -6.693 -4.347 -8.269 1.00 43.41 O ATOM 1461 CB LYS A 87 -6.759 -5.279 -11.618 1.00 21.13 C ATOM 1462 CG LYS A 87 -6.420 -6.264 -12.756 1.00 12.24 C ATOM 1463 CD LYS A 87 -6.954 -7.691 -12.526 1.00 35.34 C ATOM 1464 CE LYS A 87 -6.621 -8.625 -13.696 1.00 43.21 C ATOM 1465 NZ LYS A 87 -7.183 -9.988 -13.496 1.00 11.50 N ATOM 0 H LYS A 87 -7.630 -6.764 -9.637 1.00 13.24 H new ATOM 0 HA LYS A 87 -4.992 -5.761 -10.475 1.00 13.40 H new ATOM 0 HB2 LYS A 87 -7.835 -5.307 -11.447 1.00 21.13 H new ATOM 0 HB3 LYS A 87 -6.515 -4.270 -11.951 1.00 21.13 H new ATOM 0 HG2 LYS A 87 -6.829 -5.880 -13.690 1.00 12.24 H new ATOM 0 HG3 LYS A 87 -5.337 -6.307 -12.876 1.00 12.24 H new ATOM 0 HD2 LYS A 87 -6.527 -8.094 -11.608 1.00 35.34 H new ATOM 0 HD3 LYS A 87 -8.034 -7.656 -12.387 1.00 35.34 H new ATOM 0 HE2 LYS A 87 -7.014 -8.203 -14.621 1.00 43.21 H new ATOM 0 HE3 LYS A 87 -5.539 -8.692 -13.811 1.00 43.21 H new ATOM 0 HZ1 LYS A 87 -7.162 -10.508 -14.397 1.00 11.50 H new ATOM 0 HZ2 LYS A 87 -6.615 -10.497 -12.789 1.00 11.50 H new ATOM 0 HZ3 LYS A 87 -8.165 -9.913 -13.162 1.00 11.50 H new ATOM 1479 N TYR A 88 -5.590 -3.166 -9.878 1.00 2.02 N ATOM 1480 CA TYR A 88 -5.582 -1.871 -9.183 1.00 31.23 C ATOM 1481 C TYR A 88 -4.896 -1.978 -7.802 1.00 12.21 C ATOM 1482 O TYR A 88 -5.565 -2.006 -6.759 1.00 64.32 O ATOM 1483 CB TYR A 88 -7.012 -1.271 -9.081 1.00 71.31 C ATOM 1484 CG TYR A 88 -7.638 -0.908 -10.432 1.00 75.01 C ATOM 1485 CD1 TYR A 88 -8.347 -1.850 -11.184 1.00 61.14 C ATOM 1486 CD2 TYR A 88 -7.532 0.388 -10.953 1.00 4.55 C ATOM 1487 CE1 TYR A 88 -8.924 -1.511 -12.394 1.00 14.23 C ATOM 1488 CE2 TYR A 88 -8.106 0.723 -12.163 1.00 3.22 C ATOM 1489 CZ TYR A 88 -8.802 -0.228 -12.878 1.00 55.44 C ATOM 1490 OH TYR A 88 -9.386 0.102 -14.083 1.00 71.11 O ATOM 0 H TYR A 88 -5.142 -3.136 -10.794 1.00 2.02 H new ATOM 0 HA TYR A 88 -4.990 -1.178 -9.780 1.00 31.23 H new ATOM 0 HB2 TYR A 88 -7.659 -1.987 -8.574 1.00 71.31 H new ATOM 0 HB3 TYR A 88 -6.975 -0.377 -8.458 1.00 71.31 H new ATOM 0 HD1 TYR A 88 -8.446 -2.860 -10.813 1.00 61.14 H new ATOM 0 HD2 TYR A 88 -6.991 1.140 -10.397 1.00 4.55 H new ATOM 0 HE1 TYR A 88 -9.470 -2.252 -12.959 1.00 14.23 H new ATOM 0 HE2 TYR A 88 -8.010 1.727 -12.548 1.00 3.22 H new ATOM 0 HH TYR A 88 -9.210 1.045 -14.285 1.00 71.11 H new ATOM 1500 N PRO A 89 -3.538 -2.098 -7.787 1.00 51.23 N ATOM 1501 CA PRO A 89 -2.770 -2.153 -6.539 1.00 54.11 C ATOM 1502 C PRO A 89 -2.441 -0.760 -5.988 1.00 21.55 C ATOM 1503 O PRO A 89 -2.597 0.266 -6.671 1.00 3.21 O ATOM 1504 CB PRO A 89 -1.493 -2.895 -6.971 1.00 1.24 C ATOM 1505 CG PRO A 89 -1.270 -2.459 -8.386 1.00 62.12 C ATOM 1506 CD PRO A 89 -2.641 -2.201 -8.981 1.00 53.11 C ATOM 0 HA PRO A 89 -3.315 -2.639 -5.730 1.00 54.11 H new ATOM 0 HB2 PRO A 89 -0.647 -2.632 -6.336 1.00 1.24 H new ATOM 0 HB3 PRO A 89 -1.619 -3.976 -6.903 1.00 1.24 H new ATOM 0 HG2 PRO A 89 -0.656 -1.559 -8.422 1.00 62.12 H new ATOM 0 HG3 PRO A 89 -0.741 -3.228 -8.950 1.00 62.12 H new ATOM 0 HD2 PRO A 89 -2.654 -1.285 -9.571 1.00 53.11 H new ATOM 0 HD3 PRO A 89 -2.948 -3.011 -9.643 1.00 53.11 H new ATOM 1514 N PHE A 90 -2.012 -0.744 -4.731 1.00 34.10 N ATOM 1515 CA PHE A 90 -1.441 0.428 -4.084 1.00 11.35 C ATOM 1516 C PHE A 90 -0.136 0.032 -3.394 1.00 3.11 C ATOM 1517 O PHE A 90 0.060 -1.129 -3.026 1.00 22.10 O ATOM 1518 CB PHE A 90 -2.445 1.047 -3.085 1.00 13.04 C ATOM 1519 CG PHE A 90 -2.888 0.147 -1.923 1.00 20.35 C ATOM 1520 CD1 PHE A 90 -3.923 -0.782 -2.085 1.00 2.12 C ATOM 1521 CD2 PHE A 90 -2.282 0.238 -0.663 1.00 33.41 C ATOM 1522 CE1 PHE A 90 -4.332 -1.586 -1.032 1.00 64.32 C ATOM 1523 CE2 PHE A 90 -2.693 -0.569 0.385 1.00 33.53 C ATOM 1524 CZ PHE A 90 -3.715 -1.476 0.200 1.00 71.10 C ATOM 0 H PHE A 90 -2.053 -1.562 -4.123 1.00 34.10 H new ATOM 0 HA PHE A 90 -1.225 1.190 -4.833 1.00 11.35 H new ATOM 0 HB2 PHE A 90 -2.000 1.951 -2.668 1.00 13.04 H new ATOM 0 HB3 PHE A 90 -3.333 1.354 -3.638 1.00 13.04 H new ATOM 0 HD1 PHE A 90 -4.410 -0.874 -3.045 1.00 2.12 H new ATOM 0 HD2 PHE A 90 -1.483 0.948 -0.507 1.00 33.41 H new ATOM 0 HE1 PHE A 90 -5.132 -2.298 -1.174 1.00 64.32 H new ATOM 0 HE2 PHE A 90 -2.212 -0.488 1.349 1.00 33.53 H new ATOM 0 HZ PHE A 90 -4.034 -2.102 1.020 1.00 71.10 H new ATOM 1534 N GLN A 91 0.742 1.010 -3.232 1.00 45.31 N ATOM 1535 CA GLN A 91 2.055 0.836 -2.622 1.00 31.34 C ATOM 1536 C GLN A 91 2.034 1.394 -1.198 1.00 31.22 C ATOM 1537 O GLN A 91 1.333 2.371 -0.903 1.00 12.13 O ATOM 1538 CB GLN A 91 3.122 1.559 -3.487 1.00 64.05 C ATOM 1539 CG GLN A 91 2.981 3.097 -3.539 1.00 15.35 C ATOM 1540 CD GLN A 91 3.769 3.738 -4.673 1.00 10.52 C ATOM 1541 OE1 GLN A 91 4.936 4.104 -4.513 1.00 3.34 O ATOM 1542 NE2 GLN A 91 3.126 3.885 -5.825 1.00 20.13 N ATOM 0 H GLN A 91 0.559 1.969 -3.527 1.00 45.31 H new ATOM 0 HA GLN A 91 2.308 -0.223 -2.572 1.00 31.34 H new ATOM 0 HB2 GLN A 91 4.111 1.312 -3.101 1.00 64.05 H new ATOM 0 HB3 GLN A 91 3.070 1.169 -4.504 1.00 64.05 H new ATOM 0 HG2 GLN A 91 1.927 3.354 -3.648 1.00 15.35 H new ATOM 0 HG3 GLN A 91 3.316 3.517 -2.591 1.00 15.35 H new ATOM 0 HE21 GLN A 91 2.161 3.568 -5.914 1.00 20.13 H new ATOM 0 HE22 GLN A 91 3.597 4.315 -6.621 1.00 20.13 H new ATOM 1551 N VAL A 92 2.804 0.749 -0.331 1.00 40.22 N ATOM 1552 CA VAL A 92 3.049 1.186 1.034 1.00 51.43 C ATOM 1553 C VAL A 92 4.562 1.294 1.165 1.00 5.41 C ATOM 1554 O VAL A 92 5.249 0.276 1.302 1.00 54.41 O ATOM 1555 CB VAL A 92 2.461 0.172 2.101 1.00 11.23 C ATOM 1556 CG1 VAL A 92 2.801 0.609 3.550 1.00 10.34 C ATOM 1557 CG2 VAL A 92 0.933 -0.013 1.910 1.00 70.23 C ATOM 0 H VAL A 92 3.288 -0.117 -0.567 1.00 40.22 H new ATOM 0 HA VAL A 92 2.552 2.136 1.230 1.00 51.43 H new ATOM 0 HB VAL A 92 2.937 -0.794 1.935 1.00 11.23 H new ATOM 0 HG11 VAL A 92 2.382 -0.109 4.255 1.00 10.34 H new ATOM 0 HG12 VAL A 92 3.883 0.649 3.673 1.00 10.34 H new ATOM 0 HG13 VAL A 92 2.377 1.595 3.742 1.00 10.34 H new ATOM 0 HG21 VAL A 92 0.555 -0.714 2.655 1.00 70.23 H new ATOM 0 HG22 VAL A 92 0.432 0.948 2.029 1.00 70.23 H new ATOM 0 HG23 VAL A 92 0.736 -0.404 0.912 1.00 70.23 H new ATOM 1567 N VAL A 93 5.088 2.519 1.056 1.00 72.41 N ATOM 1568 CA VAL A 93 6.508 2.774 1.252 1.00 53.22 C ATOM 1569 C VAL A 93 6.735 2.828 2.755 1.00 4.12 C ATOM 1570 O VAL A 93 6.143 3.657 3.440 1.00 61.35 O ATOM 1571 CB VAL A 93 7.009 4.112 0.587 1.00 5.44 C ATOM 1572 CG1 VAL A 93 8.541 4.275 0.771 1.00 12.52 C ATOM 1573 CG2 VAL A 93 6.597 4.185 -0.905 1.00 62.45 C ATOM 0 H VAL A 93 4.542 3.351 0.831 1.00 72.41 H new ATOM 0 HA VAL A 93 7.077 1.980 0.769 1.00 53.22 H new ATOM 0 HB VAL A 93 6.525 4.947 1.093 1.00 5.44 H new ATOM 0 HG11 VAL A 93 8.867 5.205 0.305 1.00 12.52 H new ATOM 0 HG12 VAL A 93 8.779 4.299 1.834 1.00 12.52 H new ATOM 0 HG13 VAL A 93 9.055 3.435 0.303 1.00 12.52 H new ATOM 0 HG21 VAL A 93 6.957 5.119 -1.336 1.00 62.45 H new ATOM 0 HG22 VAL A 93 7.033 3.344 -1.444 1.00 62.45 H new ATOM 0 HG23 VAL A 93 5.511 4.143 -0.985 1.00 62.45 H new ATOM 1583 N HIS A 94 7.534 1.895 3.253 1.00 35.10 N ATOM 1584 CA HIS A 94 7.914 1.821 4.666 1.00 74.11 C ATOM 1585 C HIS A 94 9.438 1.754 4.778 1.00 35.22 C ATOM 1586 O HIS A 94 10.129 1.535 3.769 1.00 15.33 O ATOM 1587 CB HIS A 94 7.212 0.632 5.371 1.00 45.23 C ATOM 1588 CG HIS A 94 7.378 -0.726 4.715 1.00 12.04 C ATOM 1589 ND1 HIS A 94 8.284 -1.674 5.151 1.00 40.50 N ATOM 1590 CD2 HIS A 94 6.715 -1.306 3.676 1.00 22.31 C ATOM 1591 CE1 HIS A 94 8.172 -2.762 4.409 1.00 45.41 C ATOM 1592 NE2 HIS A 94 7.235 -2.565 3.507 1.00 62.13 N ATOM 0 H HIS A 94 7.945 1.156 2.683 1.00 35.10 H new ATOM 0 HA HIS A 94 7.578 2.720 5.182 1.00 74.11 H new ATOM 0 HB2 HIS A 94 7.588 0.568 6.392 1.00 45.23 H new ATOM 0 HB3 HIS A 94 6.147 0.853 5.437 1.00 45.23 H new ATOM 0 HD1 HIS A 94 8.937 -1.553 5.925 1.00 40.50 H new ATOM 0 HD2 HIS A 94 5.925 -0.857 3.092 1.00 22.31 H new ATOM 0 HE1 HIS A 94 8.754 -3.664 4.524 1.00 45.41 H new ATOM 1601 N ASP A 95 9.939 1.951 6.007 1.00 41.21 N ATOM 1602 CA ASP A 95 11.381 2.087 6.305 1.00 70.23 C ATOM 1603 C ASP A 95 12.223 0.941 5.709 1.00 63.42 C ATOM 1604 O ASP A 95 13.285 1.185 5.130 1.00 1.03 O ATOM 1605 CB ASP A 95 11.580 2.177 7.837 1.00 54.23 C ATOM 1606 CG ASP A 95 13.053 2.277 8.271 1.00 25.10 C ATOM 1607 OD1 ASP A 95 13.631 3.375 8.170 1.00 62.23 O ATOM 1608 OD2 ASP A 95 13.638 1.256 8.713 1.00 11.12 O ATOM 0 H ASP A 95 9.349 2.022 6.836 1.00 41.21 H new ATOM 0 HA ASP A 95 11.735 3.003 5.831 1.00 70.23 H new ATOM 0 HB2 ASP A 95 11.041 3.047 8.213 1.00 54.23 H new ATOM 0 HB3 ASP A 95 11.133 1.299 8.304 1.00 54.23 H new ATOM 1613 N ALA A 96 11.714 -0.294 5.832 1.00 33.23 N ATOM 1614 CA ALA A 96 12.400 -1.500 5.330 1.00 52.51 C ATOM 1615 C ALA A 96 12.489 -1.498 3.785 1.00 70.15 C ATOM 1616 O ALA A 96 13.579 -1.646 3.220 1.00 54.22 O ATOM 1617 CB ALA A 96 11.686 -2.761 5.843 1.00 70.41 C ATOM 0 H ALA A 96 10.818 -0.487 6.280 1.00 33.23 H new ATOM 0 HA ALA A 96 13.422 -1.498 5.710 1.00 52.51 H new ATOM 0 HB1 ALA A 96 12.198 -3.647 5.468 1.00 70.41 H new ATOM 0 HB2 ALA A 96 11.699 -2.768 6.933 1.00 70.41 H new ATOM 0 HB3 ALA A 96 10.654 -2.763 5.492 1.00 70.41 H new ATOM 1623 N ASN A 97 11.338 -1.286 3.119 1.00 42.51 N ATOM 1624 CA ASN A 97 11.221 -1.369 1.641 1.00 51.32 C ATOM 1625 C ASN A 97 9.856 -0.823 1.181 1.00 15.20 C ATOM 1626 O ASN A 97 9.056 -0.369 1.998 1.00 21.20 O ATOM 1627 CB ASN A 97 11.407 -2.839 1.144 1.00 14.21 C ATOM 1628 CG ASN A 97 10.367 -3.808 1.721 1.00 31.05 C ATOM 1629 OD1 ASN A 97 9.273 -3.975 1.176 1.00 21.11 O ATOM 1630 ND2 ASN A 97 10.699 -4.447 2.830 1.00 13.04 N ATOM 0 H ASN A 97 10.461 -1.052 3.585 1.00 42.51 H new ATOM 0 HA ASN A 97 12.013 -0.759 1.205 1.00 51.32 H new ATOM 0 HB2 ASN A 97 11.348 -2.858 0.056 1.00 14.21 H new ATOM 0 HB3 ASN A 97 12.405 -3.184 1.415 1.00 14.21 H new ATOM 0 HD21 ASN A 97 10.043 -5.100 3.259 1.00 13.04 H new ATOM 0 HD22 ASN A 97 11.612 -4.287 3.257 1.00 13.04 H new ATOM 1637 N THR A 98 9.599 -0.875 -0.136 1.00 74.02 N ATOM 1638 CA THR A 98 8.300 -0.500 -0.717 1.00 34.21 C ATOM 1639 C THR A 98 7.474 -1.776 -0.992 1.00 21.34 C ATOM 1640 O THR A 98 7.822 -2.577 -1.874 1.00 14.24 O ATOM 1641 CB THR A 98 8.492 0.321 -2.037 1.00 30.43 C ATOM 1642 OG1 THR A 98 9.397 1.416 -1.797 1.00 52.02 O ATOM 1643 CG2 THR A 98 7.154 0.873 -2.570 1.00 63.15 C ATOM 0 H THR A 98 10.285 -1.178 -0.827 1.00 74.02 H new ATOM 0 HA THR A 98 7.766 0.132 -0.007 1.00 34.21 H new ATOM 0 HB THR A 98 8.902 -0.352 -2.790 1.00 30.43 H new ATOM 0 HG1 THR A 98 9.518 1.928 -2.624 1.00 52.02 H new ATOM 0 HG21 THR A 98 7.332 1.436 -3.486 1.00 63.15 H new ATOM 0 HG22 THR A 98 6.476 0.045 -2.778 1.00 63.15 H new ATOM 0 HG23 THR A 98 6.707 1.528 -1.822 1.00 63.15 H new ATOM 1651 N LEU A 99 6.420 -1.983 -0.188 1.00 42.32 N ATOM 1652 CA LEU A 99 5.485 -3.112 -0.352 1.00 43.55 C ATOM 1653 C LEU A 99 4.402 -2.742 -1.386 1.00 22.24 C ATOM 1654 O LEU A 99 4.076 -1.568 -1.553 1.00 65.22 O ATOM 1655 CB LEU A 99 4.837 -3.489 1.014 1.00 70.55 C ATOM 1656 CG LEU A 99 3.871 -4.725 0.999 1.00 74.01 C ATOM 1657 CD1 LEU A 99 4.598 -6.013 0.547 1.00 63.22 C ATOM 1658 CD2 LEU A 99 3.166 -4.913 2.362 1.00 12.52 C ATOM 0 H LEU A 99 6.190 -1.373 0.596 1.00 42.32 H new ATOM 0 HA LEU A 99 6.036 -3.980 -0.713 1.00 43.55 H new ATOM 0 HB2 LEU A 99 5.635 -3.685 1.730 1.00 70.55 H new ATOM 0 HB3 LEU A 99 4.284 -2.625 1.382 1.00 70.55 H new ATOM 0 HG LEU A 99 3.095 -4.520 0.261 1.00 74.01 H new ATOM 0 HD11 LEU A 99 3.896 -6.847 0.550 1.00 63.22 H new ATOM 0 HD12 LEU A 99 4.993 -5.874 -0.459 1.00 63.22 H new ATOM 0 HD13 LEU A 99 5.418 -6.227 1.232 1.00 63.22 H new ATOM 0 HD21 LEU A 99 2.505 -5.778 2.313 1.00 12.52 H new ATOM 0 HD22 LEU A 99 3.913 -5.070 3.140 1.00 12.52 H new ATOM 0 HD23 LEU A 99 2.582 -4.023 2.595 1.00 12.52 H new ATOM 1670 N TYR A 100 3.878 -3.752 -2.105 1.00 73.23 N ATOM 1671 CA TYR A 100 2.791 -3.580 -3.092 1.00 1.54 C ATOM 1672 C TYR A 100 1.656 -4.552 -2.762 1.00 52.41 C ATOM 1673 O TYR A 100 1.873 -5.764 -2.656 1.00 75.45 O ATOM 1674 CB TYR A 100 3.325 -3.801 -4.527 1.00 23.14 C ATOM 1675 CG TYR A 100 4.395 -2.776 -4.922 1.00 42.22 C ATOM 1676 CD1 TYR A 100 4.040 -1.530 -5.448 1.00 44.42 C ATOM 1677 CD2 TYR A 100 5.753 -3.038 -4.739 1.00 44.23 C ATOM 1678 CE1 TYR A 100 5.000 -0.594 -5.777 1.00 61.43 C ATOM 1679 CE2 TYR A 100 6.714 -2.105 -5.070 1.00 70.50 C ATOM 1680 CZ TYR A 100 6.333 -0.888 -5.587 1.00 73.41 C ATOM 1681 OH TYR A 100 7.296 0.041 -5.915 1.00 2.42 O ATOM 0 H TYR A 100 4.197 -4.717 -2.018 1.00 73.23 H new ATOM 0 HA TYR A 100 2.405 -2.562 -3.042 1.00 1.54 H new ATOM 0 HB2 TYR A 100 3.742 -4.805 -4.605 1.00 23.14 H new ATOM 0 HB3 TYR A 100 2.496 -3.745 -5.232 1.00 23.14 H new ATOM 0 HD1 TYR A 100 2.997 -1.296 -5.600 1.00 44.42 H new ATOM 0 HD2 TYR A 100 6.058 -3.990 -4.330 1.00 44.23 H new ATOM 0 HE1 TYR A 100 4.708 0.364 -6.181 1.00 61.43 H new ATOM 0 HE2 TYR A 100 7.760 -2.329 -4.924 1.00 70.50 H new ATOM 0 HH TYR A 100 7.088 0.433 -6.789 1.00 2.42 H new ATOM 1691 N ILE A 101 0.455 -3.991 -2.577 1.00 1.22 N ATOM 1692 CA ILE A 101 -0.743 -4.714 -2.144 1.00 1.44 C ATOM 1693 C ILE A 101 -1.858 -4.528 -3.200 1.00 64.22 C ATOM 1694 O ILE A 101 -2.319 -3.407 -3.429 1.00 12.34 O ATOM 1695 CB ILE A 101 -1.234 -4.187 -0.739 1.00 11.20 C ATOM 1696 CG1 ILE A 101 -0.072 -4.182 0.311 1.00 41.42 C ATOM 1697 CG2 ILE A 101 -2.427 -5.020 -0.229 1.00 32.21 C ATOM 1698 CD1 ILE A 101 -0.422 -3.552 1.652 1.00 64.43 C ATOM 0 H ILE A 101 0.287 -2.996 -2.729 1.00 1.22 H new ATOM 0 HA ILE A 101 -0.504 -5.773 -2.045 1.00 1.44 H new ATOM 0 HB ILE A 101 -1.564 -3.157 -0.871 1.00 11.20 H new ATOM 0 HG12 ILE A 101 0.248 -5.210 0.482 1.00 41.42 H new ATOM 0 HG13 ILE A 101 0.779 -3.649 -0.113 1.00 41.42 H new ATOM 0 HG21 ILE A 101 -2.749 -4.639 0.740 1.00 32.21 H new ATOM 0 HG22 ILE A 101 -3.251 -4.948 -0.939 1.00 32.21 H new ATOM 0 HG23 ILE A 101 -2.126 -6.063 -0.127 1.00 32.21 H new ATOM 0 HD11 ILE A 101 0.445 -3.595 2.312 1.00 64.43 H new ATOM 0 HD12 ILE A 101 -0.711 -2.512 1.501 1.00 64.43 H new ATOM 0 HD13 ILE A 101 -1.250 -4.097 2.105 1.00 64.43 H new ATOM 1710 N PHE A 102 -2.269 -5.634 -3.835 1.00 4.25 N ATOM 1711 CA PHE A 102 -3.293 -5.651 -4.898 1.00 50.23 C ATOM 1712 C PHE A 102 -4.693 -5.759 -4.273 1.00 61.30 C ATOM 1713 O PHE A 102 -4.969 -6.697 -3.515 1.00 61.11 O ATOM 1714 CB PHE A 102 -3.019 -6.840 -5.863 1.00 53.14 C ATOM 1715 CG PHE A 102 -1.686 -6.734 -6.615 1.00 71.02 C ATOM 1716 CD1 PHE A 102 -0.465 -6.918 -5.953 1.00 64.25 C ATOM 1717 CD2 PHE A 102 -1.648 -6.417 -7.977 1.00 30.24 C ATOM 1718 CE1 PHE A 102 0.737 -6.789 -6.626 1.00 23.03 C ATOM 1719 CE2 PHE A 102 -0.441 -6.286 -8.645 1.00 35.35 C ATOM 1720 CZ PHE A 102 0.749 -6.470 -7.969 1.00 61.42 C ATOM 0 H PHE A 102 -1.895 -6.559 -3.624 1.00 4.25 H new ATOM 0 HA PHE A 102 -3.247 -4.724 -5.469 1.00 50.23 H new ATOM 0 HB2 PHE A 102 -3.030 -7.769 -5.292 1.00 53.14 H new ATOM 0 HB3 PHE A 102 -3.830 -6.901 -6.588 1.00 53.14 H new ATOM 0 HD1 PHE A 102 -0.462 -7.164 -4.901 1.00 64.25 H new ATOM 0 HD2 PHE A 102 -2.573 -6.272 -8.516 1.00 30.24 H new ATOM 0 HE1 PHE A 102 1.668 -6.938 -6.099 1.00 23.03 H new ATOM 0 HE2 PHE A 102 -0.431 -6.039 -9.696 1.00 35.35 H new ATOM 0 HZ PHE A 102 1.689 -6.364 -8.491 1.00 61.42 H new ATOM 1730 N ALA A 103 -5.572 -4.797 -4.594 1.00 54.51 N ATOM 1731 CA ALA A 103 -6.923 -4.717 -4.014 1.00 40.14 C ATOM 1732 C ALA A 103 -7.953 -5.481 -4.879 1.00 74.24 C ATOM 1733 O ALA A 103 -7.847 -5.477 -6.101 1.00 63.40 O ATOM 1734 CB ALA A 103 -7.329 -3.249 -3.852 1.00 62.25 C ATOM 0 H ALA A 103 -5.367 -4.054 -5.262 1.00 54.51 H new ATOM 0 HA ALA A 103 -6.908 -5.192 -3.033 1.00 40.14 H new ATOM 0 HB1 ALA A 103 -8.329 -3.193 -3.423 1.00 62.25 H new ATOM 0 HB2 ALA A 103 -6.622 -2.747 -3.192 1.00 62.25 H new ATOM 0 HB3 ALA A 103 -7.325 -2.761 -4.826 1.00 62.25 H new ATOM 1740 N PRO A 104 -8.977 -6.153 -4.250 1.00 20.52 N ATOM 1741 CA PRO A 104 -10.030 -6.918 -4.984 1.00 14.02 C ATOM 1742 C PRO A 104 -10.904 -6.050 -5.912 1.00 73.13 C ATOM 1743 O PRO A 104 -11.567 -6.577 -6.811 1.00 52.23 O ATOM 1744 CB PRO A 104 -10.877 -7.551 -3.845 1.00 30.44 C ATOM 1745 CG PRO A 104 -9.972 -7.535 -2.656 1.00 30.31 C ATOM 1746 CD PRO A 104 -9.176 -6.263 -2.783 1.00 32.22 C ATOM 0 HA PRO A 104 -9.586 -7.646 -5.663 1.00 14.02 H new ATOM 0 HB2 PRO A 104 -11.786 -6.978 -3.660 1.00 30.44 H new ATOM 0 HB3 PRO A 104 -11.185 -8.566 -4.096 1.00 30.44 H new ATOM 0 HG2 PRO A 104 -10.542 -7.552 -1.727 1.00 30.31 H new ATOM 0 HG3 PRO A 104 -9.320 -8.408 -2.646 1.00 30.31 H new ATOM 0 HD2 PRO A 104 -9.715 -5.405 -2.381 1.00 32.22 H new ATOM 0 HD3 PRO A 104 -8.228 -6.323 -2.248 1.00 32.22 H new ATOM 1754 N SER A 105 -10.900 -4.722 -5.691 1.00 0.41 N ATOM 1755 CA SER A 105 -11.658 -3.762 -6.521 1.00 13.34 C ATOM 1756 C SER A 105 -10.890 -2.416 -6.631 1.00 63.31 C ATOM 1757 O SER A 105 -10.148 -2.055 -5.708 1.00 71.51 O ATOM 1758 CB SER A 105 -13.071 -3.537 -5.920 1.00 31.50 C ATOM 1759 OG SER A 105 -13.793 -4.759 -5.813 1.00 33.33 O ATOM 0 H SER A 105 -10.374 -4.284 -4.935 1.00 0.41 H new ATOM 0 HA SER A 105 -11.768 -4.175 -7.524 1.00 13.34 H new ATOM 0 HB2 SER A 105 -12.980 -3.080 -4.935 1.00 31.50 H new ATOM 0 HB3 SER A 105 -13.627 -2.838 -6.546 1.00 31.50 H new ATOM 0 HG SER A 105 -14.678 -4.584 -5.430 1.00 33.33 H new ATOM 1765 N PRO A 106 -11.045 -1.657 -7.775 1.00 64.41 N ATOM 1766 CA PRO A 106 -10.498 -0.274 -7.928 1.00 62.13 C ATOM 1767 C PRO A 106 -10.954 0.710 -6.822 1.00 74.31 C ATOM 1768 O PRO A 106 -10.229 1.662 -6.497 1.00 62.41 O ATOM 1769 CB PRO A 106 -11.005 0.185 -9.332 1.00 5.45 C ATOM 1770 CG PRO A 106 -12.014 -0.839 -9.768 1.00 15.32 C ATOM 1771 CD PRO A 106 -11.678 -2.122 -9.042 1.00 54.22 C ATOM 0 HA PRO A 106 -9.412 -0.279 -7.837 1.00 62.13 H new ATOM 0 HB2 PRO A 106 -11.455 1.176 -9.279 1.00 5.45 H new ATOM 0 HB3 PRO A 106 -10.181 0.247 -10.043 1.00 5.45 H new ATOM 0 HG2 PRO A 106 -13.025 -0.512 -9.527 1.00 15.32 H new ATOM 0 HG3 PRO A 106 -11.975 -0.984 -10.848 1.00 15.32 H new ATOM 0 HD2 PRO A 106 -12.570 -2.718 -8.849 1.00 54.22 H new ATOM 0 HD3 PRO A 106 -10.999 -2.745 -9.624 1.00 54.22 H new ATOM 1779 N GLN A 107 -12.115 0.423 -6.204 1.00 1.43 N ATOM 1780 CA GLN A 107 -12.712 1.302 -5.173 1.00 63.50 C ATOM 1781 C GLN A 107 -12.087 0.959 -3.804 1.00 55.22 C ATOM 1782 O GLN A 107 -11.915 1.828 -2.944 1.00 62.25 O ATOM 1783 CB GLN A 107 -14.260 1.130 -5.138 1.00 31.44 C ATOM 1784 CG GLN A 107 -14.750 -0.296 -4.796 1.00 52.11 C ATOM 1785 CD GLN A 107 -16.273 -0.435 -4.774 1.00 33.23 C ATOM 1786 OE1 GLN A 107 -16.909 -0.244 -3.740 1.00 50.54 O ATOM 1787 NE2 GLN A 107 -16.864 -0.768 -5.910 1.00 34.14 N ATOM 0 H GLN A 107 -12.663 -0.415 -6.400 1.00 1.43 H new ATOM 0 HA GLN A 107 -12.503 2.345 -5.413 1.00 63.50 H new ATOM 0 HB2 GLN A 107 -14.672 1.825 -4.406 1.00 31.44 H new ATOM 0 HB3 GLN A 107 -14.664 1.414 -6.110 1.00 31.44 H new ATOM 0 HG2 GLN A 107 -14.341 -0.996 -5.525 1.00 52.11 H new ATOM 0 HG3 GLN A 107 -14.354 -0.583 -3.822 1.00 52.11 H new ATOM 0 HE21 GLN A 107 -16.306 -0.919 -6.750 1.00 34.14 H new ATOM 0 HE22 GLN A 107 -17.878 -0.873 -5.946 1.00 34.14 H new ATOM 1796 N SER A 108 -11.737 -0.335 -3.649 1.00 31.12 N ATOM 1797 CA SER A 108 -11.089 -0.895 -2.453 1.00 72.22 C ATOM 1798 C SER A 108 -9.666 -0.339 -2.308 1.00 63.43 C ATOM 1799 O SER A 108 -9.236 0.023 -1.209 1.00 14.02 O ATOM 1800 CB SER A 108 -11.057 -2.432 -2.586 1.00 1.23 C ATOM 1801 OG SER A 108 -12.369 -2.945 -2.756 1.00 32.31 O ATOM 0 H SER A 108 -11.903 -1.034 -4.373 1.00 31.12 H new ATOM 0 HA SER A 108 -11.651 -0.615 -1.562 1.00 72.22 H new ATOM 0 HB2 SER A 108 -10.436 -2.716 -3.436 1.00 1.23 H new ATOM 0 HB3 SER A 108 -10.601 -2.870 -1.698 1.00 1.23 H new ATOM 0 HG SER A 108 -12.330 -3.921 -2.840 1.00 32.31 H new ATOM 1807 N ARG A 109 -8.953 -0.296 -3.454 1.00 11.35 N ATOM 1808 CA ARG A 109 -7.631 0.344 -3.599 1.00 12.32 C ATOM 1809 C ARG A 109 -7.658 1.772 -3.048 1.00 75.04 C ATOM 1810 O ARG A 109 -6.909 2.107 -2.127 1.00 23.31 O ATOM 1811 CB ARG A 109 -7.258 0.359 -5.112 1.00 73.03 C ATOM 1812 CG ARG A 109 -6.023 1.216 -5.510 1.00 64.41 C ATOM 1813 CD ARG A 109 -6.099 1.685 -6.979 1.00 14.32 C ATOM 1814 NE ARG A 109 -7.392 2.360 -7.245 1.00 51.12 N ATOM 1815 CZ ARG A 109 -7.561 3.547 -7.848 1.00 54.52 C ATOM 1816 NH1 ARG A 109 -6.531 4.253 -8.291 1.00 63.21 N ATOM 1817 NH2 ARG A 109 -8.785 4.035 -7.975 1.00 64.00 N ATOM 0 H ARG A 109 -9.289 -0.715 -4.321 1.00 11.35 H new ATOM 0 HA ARG A 109 -6.887 -0.217 -3.033 1.00 12.32 H new ATOM 0 HB2 ARG A 109 -7.078 -0.668 -5.430 1.00 73.03 H new ATOM 0 HB3 ARG A 109 -8.120 0.720 -5.673 1.00 73.03 H new ATOM 0 HG2 ARG A 109 -5.957 2.084 -4.854 1.00 64.41 H new ATOM 0 HG3 ARG A 109 -5.114 0.634 -5.361 1.00 64.41 H new ATOM 0 HD2 ARG A 109 -5.276 2.367 -7.192 1.00 14.32 H new ATOM 0 HD3 ARG A 109 -5.985 0.830 -7.646 1.00 14.32 H new ATOM 0 HE ARG A 109 -8.236 1.875 -6.940 1.00 51.12 H new ATOM 0 HH11 ARG A 109 -5.582 3.897 -8.177 1.00 63.21 H new ATOM 0 HH12 ARG A 109 -6.687 5.153 -8.746 1.00 63.21 H new ATOM 0 HH21 ARG A 109 -9.583 3.510 -7.617 1.00 64.00 H new ATOM 0 HH22 ARG A 109 -8.930 4.936 -8.431 1.00 64.00 H new ATOM 1831 N ASP A 110 -8.582 2.573 -3.604 1.00 62.02 N ATOM 1832 CA ASP A 110 -8.695 4.009 -3.319 1.00 44.13 C ATOM 1833 C ASP A 110 -9.098 4.264 -1.851 1.00 23.51 C ATOM 1834 O ASP A 110 -8.677 5.257 -1.251 1.00 32.14 O ATOM 1835 CB ASP A 110 -9.715 4.653 -4.289 1.00 71.01 C ATOM 1836 CG ASP A 110 -9.785 6.185 -4.138 1.00 2.01 C ATOM 1837 OD1 ASP A 110 -8.861 6.874 -4.625 1.00 63.21 O ATOM 1838 OD2 ASP A 110 -10.744 6.707 -3.522 1.00 22.25 O ATOM 0 H ASP A 110 -9.277 2.236 -4.270 1.00 62.02 H new ATOM 0 HA ASP A 110 -7.718 4.469 -3.470 1.00 44.13 H new ATOM 0 HB2 ASP A 110 -9.443 4.404 -5.315 1.00 71.01 H new ATOM 0 HB3 ASP A 110 -10.702 4.228 -4.108 1.00 71.01 H new ATOM 1843 N LEU A 111 -9.902 3.337 -1.298 1.00 14.12 N ATOM 1844 CA LEU A 111 -10.365 3.373 0.102 1.00 20.25 C ATOM 1845 C LEU A 111 -9.182 3.218 1.080 1.00 64.34 C ATOM 1846 O LEU A 111 -9.024 4.021 2.002 1.00 43.44 O ATOM 1847 CB LEU A 111 -11.412 2.246 0.339 1.00 31.23 C ATOM 1848 CG LEU A 111 -12.036 2.161 1.769 1.00 4.43 C ATOM 1849 CD1 LEU A 111 -12.781 3.462 2.151 1.00 73.24 C ATOM 1850 CD2 LEU A 111 -12.942 0.910 1.904 1.00 74.41 C ATOM 0 H LEU A 111 -10.253 2.532 -1.817 1.00 14.12 H new ATOM 0 HA LEU A 111 -10.830 4.341 0.288 1.00 20.25 H new ATOM 0 HB2 LEU A 111 -12.222 2.377 -0.379 1.00 31.23 H new ATOM 0 HB3 LEU A 111 -10.939 1.289 0.116 1.00 31.23 H new ATOM 0 HG LEU A 111 -11.219 2.052 2.482 1.00 4.43 H new ATOM 0 HD11 LEU A 111 -13.200 3.361 3.152 1.00 73.24 H new ATOM 0 HD12 LEU A 111 -12.084 4.300 2.132 1.00 73.24 H new ATOM 0 HD13 LEU A 111 -13.585 3.643 1.438 1.00 73.24 H new ATOM 0 HD21 LEU A 111 -13.364 0.873 2.908 1.00 74.41 H new ATOM 0 HD22 LEU A 111 -13.749 0.964 1.173 1.00 74.41 H new ATOM 0 HD23 LEU A 111 -12.351 0.012 1.726 1.00 74.41 H new ATOM 1862 N TRP A 112 -8.381 2.161 0.871 1.00 2.40 N ATOM 1863 CA TRP A 112 -7.173 1.886 1.676 1.00 62.42 C ATOM 1864 C TRP A 112 -6.136 3.018 1.580 1.00 65.31 C ATOM 1865 O TRP A 112 -5.562 3.416 2.600 1.00 13.31 O ATOM 1866 CB TRP A 112 -6.547 0.530 1.267 1.00 61.35 C ATOM 1867 CG TRP A 112 -7.199 -0.646 1.944 1.00 11.21 C ATOM 1868 CD1 TRP A 112 -8.243 -1.401 1.496 1.00 74.22 C ATOM 1869 CD2 TRP A 112 -6.847 -1.167 3.231 1.00 60.02 C ATOM 1870 NE1 TRP A 112 -8.554 -2.362 2.422 1.00 61.25 N ATOM 1871 CE2 TRP A 112 -7.707 -2.244 3.495 1.00 71.33 C ATOM 1872 CE3 TRP A 112 -5.873 -0.833 4.173 1.00 64.41 C ATOM 1873 CZ2 TRP A 112 -7.633 -2.983 4.672 1.00 22.31 C ATOM 1874 CZ3 TRP A 112 -5.801 -1.563 5.338 1.00 3.53 C ATOM 1875 CH2 TRP A 112 -6.670 -2.632 5.578 1.00 45.32 C ATOM 0 H TRP A 112 -8.550 1.471 0.139 1.00 2.40 H new ATOM 0 HA TRP A 112 -7.485 1.830 2.719 1.00 62.42 H new ATOM 0 HB2 TRP A 112 -6.627 0.410 0.187 1.00 61.35 H new ATOM 0 HB3 TRP A 112 -5.484 0.539 1.509 1.00 61.35 H new ATOM 0 HD1 TRP A 112 -8.749 -1.262 0.552 1.00 74.22 H new ATOM 0 HE1 TRP A 112 -9.297 -3.055 2.329 1.00 61.25 H new ATOM 0 HE3 TRP A 112 -5.189 -0.017 3.992 1.00 64.41 H new ATOM 0 HZ2 TRP A 112 -8.310 -3.802 4.863 1.00 22.31 H new ATOM 0 HZ3 TRP A 112 -5.060 -1.305 6.080 1.00 3.53 H new ATOM 0 HH2 TRP A 112 -6.579 -3.192 6.497 1.00 45.32 H new ATOM 1886 N VAL A 113 -5.915 3.533 0.356 1.00 1.21 N ATOM 1887 CA VAL A 113 -4.995 4.665 0.125 1.00 25.14 C ATOM 1888 C VAL A 113 -5.486 5.907 0.878 1.00 43.03 C ATOM 1889 O VAL A 113 -4.686 6.608 1.480 1.00 43.13 O ATOM 1890 CB VAL A 113 -4.829 4.999 -1.405 1.00 2.10 C ATOM 1891 CG1 VAL A 113 -3.949 6.256 -1.643 1.00 72.23 C ATOM 1892 CG2 VAL A 113 -4.251 3.792 -2.150 1.00 41.24 C ATOM 0 H VAL A 113 -6.362 3.183 -0.491 1.00 1.21 H new ATOM 0 HA VAL A 113 -4.017 4.367 0.503 1.00 25.14 H new ATOM 0 HB VAL A 113 -5.821 5.224 -1.797 1.00 2.10 H new ATOM 0 HG11 VAL A 113 -3.865 6.444 -2.713 1.00 72.23 H new ATOM 0 HG12 VAL A 113 -4.407 7.118 -1.158 1.00 72.23 H new ATOM 0 HG13 VAL A 113 -2.956 6.090 -1.225 1.00 72.23 H new ATOM 0 HG21 VAL A 113 -4.141 4.035 -3.207 1.00 41.24 H new ATOM 0 HG22 VAL A 113 -3.276 3.539 -1.732 1.00 41.24 H new ATOM 0 HG23 VAL A 113 -4.924 2.941 -2.042 1.00 41.24 H new ATOM 1902 N LYS A 114 -6.813 6.126 0.853 1.00 72.41 N ATOM 1903 CA LYS A 114 -7.470 7.257 1.531 1.00 70.35 C ATOM 1904 C LYS A 114 -7.220 7.211 3.050 1.00 43.52 C ATOM 1905 O LYS A 114 -6.697 8.170 3.616 1.00 71.30 O ATOM 1906 CB LYS A 114 -8.993 7.228 1.227 1.00 11.23 C ATOM 1907 CG LYS A 114 -9.810 8.381 1.843 1.00 51.20 C ATOM 1908 CD LYS A 114 -11.316 8.279 1.503 1.00 1.33 C ATOM 1909 CE LYS A 114 -12.111 9.499 1.982 1.00 5.40 C ATOM 1910 NZ LYS A 114 -13.555 9.390 1.637 1.00 42.31 N ATOM 0 H LYS A 114 -7.465 5.518 0.357 1.00 72.41 H new ATOM 0 HA LYS A 114 -7.046 8.188 1.154 1.00 70.35 H new ATOM 0 HB2 LYS A 114 -9.131 7.244 0.146 1.00 11.23 H new ATOM 0 HB3 LYS A 114 -9.401 6.283 1.587 1.00 11.23 H new ATOM 0 HG2 LYS A 114 -9.683 8.376 2.926 1.00 51.20 H new ATOM 0 HG3 LYS A 114 -9.421 9.333 1.481 1.00 51.20 H new ATOM 0 HD2 LYS A 114 -11.435 8.173 0.425 1.00 1.33 H new ATOM 0 HD3 LYS A 114 -11.728 7.379 1.960 1.00 1.33 H new ATOM 0 HE2 LYS A 114 -12.002 9.602 3.062 1.00 5.40 H new ATOM 0 HE3 LYS A 114 -11.697 10.402 1.532 1.00 5.40 H new ATOM 0 HZ1 LYS A 114 -14.058 10.234 1.978 1.00 42.31 H new ATOM 0 HZ2 LYS A 114 -13.661 9.317 0.605 1.00 42.31 H new ATOM 0 HZ3 LYS A 114 -13.956 8.543 2.087 1.00 42.31 H new ATOM 1924 N LYS A 115 -7.572 6.068 3.675 1.00 3.10 N ATOM 1925 CA LYS A 115 -7.460 5.860 5.137 1.00 5.40 C ATOM 1926 C LYS A 115 -6.010 6.036 5.632 1.00 31.32 C ATOM 1927 O LYS A 115 -5.754 6.777 6.591 1.00 51.43 O ATOM 1928 CB LYS A 115 -7.994 4.448 5.523 1.00 12.23 C ATOM 1929 CG LYS A 115 -9.495 4.225 5.244 1.00 24.41 C ATOM 1930 CD LYS A 115 -10.388 5.249 5.977 1.00 1.54 C ATOM 1931 CE LYS A 115 -11.887 4.995 5.780 1.00 70.33 C ATOM 1932 NZ LYS A 115 -12.709 5.981 6.537 1.00 3.25 N ATOM 0 H LYS A 115 -7.944 5.258 3.178 1.00 3.10 H new ATOM 0 HA LYS A 115 -8.069 6.621 5.625 1.00 5.40 H new ATOM 0 HB2 LYS A 115 -7.422 3.697 4.978 1.00 12.23 H new ATOM 0 HB3 LYS A 115 -7.808 4.282 6.584 1.00 12.23 H new ATOM 0 HG2 LYS A 115 -9.676 4.291 4.171 1.00 24.41 H new ATOM 0 HG3 LYS A 115 -9.773 3.217 5.553 1.00 24.41 H new ATOM 0 HD2 LYS A 115 -10.159 5.224 7.042 1.00 1.54 H new ATOM 0 HD3 LYS A 115 -10.146 6.251 5.623 1.00 1.54 H new ATOM 0 HE2 LYS A 115 -12.131 5.053 4.719 1.00 70.33 H new ATOM 0 HE3 LYS A 115 -12.133 3.985 6.109 1.00 70.33 H new ATOM 0 HZ1 LYS A 115 -13.718 5.782 6.383 1.00 3.25 H new ATOM 0 HZ2 LYS A 115 -12.492 5.907 7.552 1.00 3.25 H new ATOM 0 HZ3 LYS A 115 -12.491 6.942 6.205 1.00 3.25 H new ATOM 1946 N LEU A 116 -5.079 5.360 4.942 1.00 62.31 N ATOM 1947 CA LEU A 116 -3.641 5.397 5.261 1.00 21.11 C ATOM 1948 C LEU A 116 -3.068 6.823 5.096 1.00 52.44 C ATOM 1949 O LEU A 116 -2.345 7.301 5.969 1.00 50.55 O ATOM 1950 CB LEU A 116 -2.892 4.356 4.373 1.00 51.44 C ATOM 1951 CG LEU A 116 -2.988 2.863 4.855 1.00 62.54 C ATOM 1952 CD1 LEU A 116 -2.692 1.851 3.722 1.00 62.20 C ATOM 1953 CD2 LEU A 116 -2.052 2.628 6.062 1.00 13.04 C ATOM 0 H LEU A 116 -5.303 4.768 4.142 1.00 62.31 H new ATOM 0 HA LEU A 116 -3.494 5.127 6.307 1.00 21.11 H new ATOM 0 HB2 LEU A 116 -3.287 4.418 3.359 1.00 51.44 H new ATOM 0 HB3 LEU A 116 -1.840 4.637 4.323 1.00 51.44 H new ATOM 0 HG LEU A 116 -4.019 2.690 5.165 1.00 62.54 H new ATOM 0 HD11 LEU A 116 -2.772 0.836 4.111 1.00 62.20 H new ATOM 0 HD12 LEU A 116 -3.411 1.988 2.914 1.00 62.20 H new ATOM 0 HD13 LEU A 116 -1.684 2.015 3.342 1.00 62.20 H new ATOM 0 HD21 LEU A 116 -2.129 1.590 6.385 1.00 13.04 H new ATOM 0 HD22 LEU A 116 -1.023 2.843 5.772 1.00 13.04 H new ATOM 0 HD23 LEU A 116 -2.343 3.286 6.881 1.00 13.04 H new ATOM 1965 N LYS A 117 -3.402 7.474 3.965 1.00 55.34 N ATOM 1966 CA LYS A 117 -3.052 8.889 3.670 1.00 43.05 C ATOM 1967 C LYS A 117 -3.505 9.856 4.790 1.00 31.31 C ATOM 1968 O LYS A 117 -2.734 10.725 5.225 1.00 15.53 O ATOM 1969 CB LYS A 117 -3.689 9.296 2.314 1.00 42.40 C ATOM 1970 CG LYS A 117 -3.263 10.662 1.741 1.00 53.15 C ATOM 1971 CD LYS A 117 -3.955 10.976 0.391 1.00 2.12 C ATOM 1972 CE LYS A 117 -3.698 9.912 -0.697 1.00 74.22 C ATOM 1973 NZ LYS A 117 -2.246 9.722 -0.979 1.00 15.31 N ATOM 0 H LYS A 117 -3.931 7.030 3.215 1.00 55.34 H new ATOM 0 HA LYS A 117 -1.966 8.964 3.614 1.00 43.05 H new ATOM 0 HB2 LYS A 117 -3.449 8.527 1.579 1.00 42.40 H new ATOM 0 HB3 LYS A 117 -4.773 9.298 2.432 1.00 42.40 H new ATOM 0 HG2 LYS A 117 -3.502 11.445 2.460 1.00 53.15 H new ATOM 0 HG3 LYS A 117 -2.182 10.675 1.604 1.00 53.15 H new ATOM 0 HD2 LYS A 117 -5.029 11.064 0.555 1.00 2.12 H new ATOM 0 HD3 LYS A 117 -3.607 11.944 0.030 1.00 2.12 H new ATOM 0 HE2 LYS A 117 -4.131 8.963 -0.381 1.00 74.22 H new ATOM 0 HE3 LYS A 117 -4.208 10.205 -1.615 1.00 74.22 H new ATOM 0 HZ1 LYS A 117 -2.052 9.956 -1.974 1.00 15.31 H new ATOM 0 HZ2 LYS A 117 -1.688 10.345 -0.361 1.00 15.31 H new ATOM 0 HZ3 LYS A 117 -1.984 8.732 -0.799 1.00 15.31 H new ATOM 1987 N GLU A 118 -4.761 9.673 5.248 1.00 34.30 N ATOM 1988 CA GLU A 118 -5.362 10.482 6.334 1.00 41.14 C ATOM 1989 C GLU A 118 -4.620 10.310 7.673 1.00 43.42 C ATOM 1990 O GLU A 118 -4.675 11.196 8.527 1.00 43.12 O ATOM 1991 CB GLU A 118 -6.867 10.132 6.517 1.00 14.24 C ATOM 1992 CG GLU A 118 -7.783 10.576 5.358 1.00 54.42 C ATOM 1993 CD GLU A 118 -9.264 10.248 5.615 1.00 75.54 C ATOM 1994 OE1 GLU A 118 -9.978 11.100 6.205 1.00 11.11 O ATOM 1995 OE2 GLU A 118 -9.719 9.136 5.246 1.00 74.43 O ATOM 0 H GLU A 118 -5.389 8.960 4.876 1.00 34.30 H new ATOM 0 HA GLU A 118 -5.267 11.526 6.034 1.00 41.14 H new ATOM 0 HB2 GLU A 118 -6.961 9.053 6.643 1.00 14.24 H new ATOM 0 HB3 GLU A 118 -7.223 10.593 7.439 1.00 14.24 H new ATOM 0 HG2 GLU A 118 -7.674 11.650 5.204 1.00 54.42 H new ATOM 0 HG3 GLU A 118 -7.461 10.088 4.438 1.00 54.42 H new ATOM 2002 N GLU A 119 -3.939 9.171 7.853 1.00 71.43 N ATOM 2003 CA GLU A 119 -3.153 8.896 9.069 1.00 52.01 C ATOM 2004 C GLU A 119 -1.745 9.501 8.964 1.00 2.24 C ATOM 2005 O GLU A 119 -1.321 10.280 9.831 1.00 4.12 O ATOM 2006 CB GLU A 119 -3.076 7.368 9.319 1.00 33.35 C ATOM 2007 CG GLU A 119 -4.430 6.708 9.627 1.00 1.40 C ATOM 2008 CD GLU A 119 -5.137 7.314 10.859 1.00 32.35 C ATOM 2009 OE1 GLU A 119 -4.698 7.049 11.999 1.00 63.44 O ATOM 2010 OE2 GLU A 119 -6.143 8.047 10.697 1.00 40.41 O ATOM 0 H GLU A 119 -3.915 8.417 7.167 1.00 71.43 H new ATOM 0 HA GLU A 119 -3.654 9.365 9.916 1.00 52.01 H new ATOM 0 HB2 GLU A 119 -2.643 6.889 8.441 1.00 33.35 H new ATOM 0 HB3 GLU A 119 -2.397 7.182 10.151 1.00 33.35 H new ATOM 0 HG2 GLU A 119 -5.081 6.806 8.758 1.00 1.40 H new ATOM 0 HG3 GLU A 119 -4.278 5.641 9.792 1.00 1.40 H new ATOM 2017 N ILE A 120 -1.046 9.180 7.866 1.00 63.25 N ATOM 2018 CA ILE A 120 0.392 9.476 7.711 1.00 40.44 C ATOM 2019 C ILE A 120 0.667 10.972 7.438 1.00 23.13 C ATOM 2020 O ILE A 120 1.816 11.412 7.522 1.00 72.30 O ATOM 2021 CB ILE A 120 1.030 8.582 6.578 1.00 40.13 C ATOM 2022 CG1 ILE A 120 0.349 8.855 5.197 1.00 31.13 C ATOM 2023 CG2 ILE A 120 0.949 7.083 6.956 1.00 14.00 C ATOM 2024 CD1 ILE A 120 0.889 8.036 4.036 1.00 43.14 C ATOM 0 H ILE A 120 -1.457 8.709 7.060 1.00 63.25 H new ATOM 0 HA ILE A 120 0.864 9.234 8.663 1.00 40.44 H new ATOM 0 HB ILE A 120 2.082 8.850 6.485 1.00 40.13 H new ATOM 0 HG12 ILE A 120 -0.719 8.661 5.292 1.00 31.13 H new ATOM 0 HG13 ILE A 120 0.461 9.913 4.958 1.00 31.13 H new ATOM 0 HG21 ILE A 120 1.394 6.483 6.162 1.00 14.00 H new ATOM 0 HG22 ILE A 120 1.490 6.913 7.887 1.00 14.00 H new ATOM 0 HG23 ILE A 120 -0.095 6.796 7.086 1.00 14.00 H new ATOM 0 HD11 ILE A 120 0.352 8.299 3.125 1.00 43.14 H new ATOM 0 HD12 ILE A 120 1.951 8.246 3.905 1.00 43.14 H new ATOM 0 HD13 ILE A 120 0.752 6.975 4.245 1.00 43.14 H new ATOM 2036 N LYS A 121 -0.396 11.750 7.150 1.00 52.11 N ATOM 2037 CA LYS A 121 -0.287 13.209 6.909 1.00 3.30 C ATOM 2038 C LYS A 121 0.202 13.954 8.166 1.00 60.31 C ATOM 2039 O LYS A 121 0.910 14.962 8.068 1.00 4.34 O ATOM 2040 CB LYS A 121 -1.646 13.795 6.423 1.00 12.35 C ATOM 2041 CG LYS A 121 -2.837 13.535 7.361 1.00 34.43 C ATOM 2042 CD LYS A 121 -4.151 14.204 6.891 1.00 64.43 C ATOM 2043 CE LYS A 121 -4.121 15.734 7.007 1.00 34.12 C ATOM 2044 NZ LYS A 121 -3.954 16.194 8.409 1.00 53.11 N ATOM 0 H LYS A 121 -1.348 11.391 7.078 1.00 52.11 H new ATOM 0 HA LYS A 121 0.454 13.356 6.123 1.00 3.30 H new ATOM 0 HB2 LYS A 121 -1.534 14.871 6.291 1.00 12.35 H new ATOM 0 HB3 LYS A 121 -1.876 13.376 5.443 1.00 12.35 H new ATOM 0 HG2 LYS A 121 -2.996 12.460 7.444 1.00 34.43 H new ATOM 0 HG3 LYS A 121 -2.590 13.899 8.358 1.00 34.43 H new ATOM 0 HD2 LYS A 121 -4.342 13.928 5.854 1.00 64.43 H new ATOM 0 HD3 LYS A 121 -4.981 13.817 7.482 1.00 64.43 H new ATOM 0 HE2 LYS A 121 -3.305 16.125 6.400 1.00 34.12 H new ATOM 0 HE3 LYS A 121 -5.046 16.144 6.601 1.00 34.12 H new ATOM 0 HZ1 LYS A 121 -3.335 17.030 8.429 1.00 53.11 H new ATOM 0 HZ2 LYS A 121 -4.883 16.442 8.806 1.00 53.11 H new ATOM 0 HZ3 LYS A 121 -3.527 15.433 8.975 1.00 53.11 H new ATOM 2058 N ASN A 122 -0.170 13.425 9.347 1.00 55.23 N ATOM 2059 CA ASN A 122 0.197 14.008 10.660 1.00 25.43 C ATOM 2060 C ASN A 122 1.590 13.533 11.117 1.00 54.32 C ATOM 2061 O ASN A 122 2.050 13.902 12.204 1.00 74.42 O ATOM 2062 CB ASN A 122 -0.880 13.657 11.724 1.00 12.51 C ATOM 2063 CG ASN A 122 -2.230 14.360 11.495 1.00 1.31 C ATOM 2064 OD1 ASN A 122 -2.614 14.670 10.370 1.00 14.52 O ATOM 2065 ND2 ASN A 122 -2.964 14.614 12.568 1.00 55.45 N ATOM 0 H ASN A 122 -0.735 12.579 9.422 1.00 55.23 H new ATOM 0 HA ASN A 122 0.240 15.091 10.548 1.00 25.43 H new ATOM 0 HB2 ASN A 122 -1.038 12.579 11.726 1.00 12.51 H new ATOM 0 HB3 ASN A 122 -0.504 13.926 12.711 1.00 12.51 H new ATOM 0 HD21 ASN A 122 -3.868 15.076 12.470 1.00 55.45 H new ATOM 0 HD22 ASN A 122 -2.625 14.348 13.492 1.00 55.45 H new ATOM 2072 N ASN A 123 2.242 12.706 10.287 1.00 63.01 N ATOM 2073 CA ASN A 123 3.619 12.233 10.517 1.00 2.02 C ATOM 2074 C ASN A 123 4.620 13.141 9.777 1.00 33.15 C ATOM 2075 O ASN A 123 4.242 13.895 8.873 1.00 74.24 O ATOM 2076 CB ASN A 123 3.793 10.775 10.004 1.00 0.23 C ATOM 2077 CG ASN A 123 2.839 9.752 10.624 1.00 42.33 C ATOM 2078 OD1 ASN A 123 1.698 10.064 10.961 1.00 72.21 O ATOM 2079 ND2 ASN A 123 3.294 8.513 10.759 1.00 5.41 N ATOM 0 H ASN A 123 1.827 12.342 9.429 1.00 63.01 H new ATOM 0 HA ASN A 123 3.811 12.263 11.590 1.00 2.02 H new ATOM 0 HB2 ASN A 123 3.656 10.768 8.923 1.00 0.23 H new ATOM 0 HB3 ASN A 123 4.818 10.458 10.198 1.00 0.23 H new ATOM 0 HD21 ASN A 123 2.692 7.789 11.151 1.00 5.41 H new ATOM 0 HD22 ASN A 123 4.245 8.285 10.470 1.00 5.41 H new ATOM 2086 N ASN A 124 5.908 13.032 10.149 1.00 22.21 N ATOM 2087 CA ASN A 124 7.028 13.705 9.442 1.00 20.23 C ATOM 2088 C ASN A 124 7.704 12.708 8.476 1.00 42.21 C ATOM 2089 O ASN A 124 8.893 12.818 8.166 1.00 61.33 O ATOM 2090 CB ASN A 124 8.054 14.253 10.473 1.00 50.54 C ATOM 2091 CG ASN A 124 7.488 15.300 11.442 1.00 20.12 C ATOM 2092 OD1 ASN A 124 7.921 15.385 12.593 1.00 3.43 O ATOM 2093 ND2 ASN A 124 6.547 16.126 10.993 1.00 13.11 N ATOM 0 H ASN A 124 6.209 12.475 10.949 1.00 22.21 H new ATOM 0 HA ASN A 124 6.641 14.544 8.864 1.00 20.23 H new ATOM 0 HB2 ASN A 124 8.450 13.418 11.051 1.00 50.54 H new ATOM 0 HB3 ASN A 124 8.893 14.693 9.933 1.00 50.54 H new ATOM 0 HD21 ASN A 124 6.168 16.849 11.605 1.00 13.11 H new ATOM 0 HD22 ASN A 124 6.204 16.037 10.037 1.00 13.11 H new ATOM 2100 N ASN A 125 6.899 11.769 7.972 1.00 14.04 N ATOM 2101 CA ASN A 125 7.364 10.606 7.192 1.00 41.44 C ATOM 2102 C ASN A 125 7.218 10.841 5.690 1.00 61.53 C ATOM 2103 O ASN A 125 7.852 10.148 4.891 1.00 21.32 O ATOM 2104 CB ASN A 125 6.522 9.368 7.581 1.00 33.04 C ATOM 2105 CG ASN A 125 6.643 8.956 9.047 1.00 21.43 C ATOM 2106 OD1 ASN A 125 7.000 9.755 9.917 1.00 64.11 O ATOM 2107 ND2 ASN A 125 6.283 7.722 9.344 1.00 33.04 N ATOM 0 H ASN A 125 5.887 11.791 8.094 1.00 14.04 H new ATOM 0 HA ASN A 125 8.419 10.449 7.417 1.00 41.44 H new ATOM 0 HB2 ASN A 125 5.475 9.572 7.359 1.00 33.04 H new ATOM 0 HB3 ASN A 125 6.823 8.528 6.955 1.00 33.04 H new ATOM 0 HD21 ASN A 125 6.295 7.407 10.314 1.00 33.04 H new ATOM 0 HD22 ASN A 125 5.992 7.083 8.604 1.00 33.04 H new ATOM 2114 N ILE A 126 6.399 11.834 5.318 1.00 71.24 N ATOM 2115 CA ILE A 126 5.898 11.970 3.948 1.00 64.34 C ATOM 2116 C ILE A 126 7.010 12.439 3.011 1.00 31.42 C ATOM 2117 O ILE A 126 7.535 13.549 3.162 1.00 2.33 O ATOM 2118 CB ILE A 126 4.686 12.971 3.855 1.00 65.42 C ATOM 2119 CG1 ILE A 126 3.557 12.574 4.847 1.00 71.14 C ATOM 2120 CG2 ILE A 126 4.139 13.036 2.404 1.00 41.11 C ATOM 2121 CD1 ILE A 126 2.910 11.243 4.541 1.00 11.03 C ATOM 0 H ILE A 126 6.068 12.559 5.954 1.00 71.24 H new ATOM 0 HA ILE A 126 5.550 10.983 3.643 1.00 64.34 H new ATOM 0 HB ILE A 126 5.047 13.962 4.132 1.00 65.42 H new ATOM 0 HG12 ILE A 126 3.968 12.543 5.856 1.00 71.14 H new ATOM 0 HG13 ILE A 126 2.791 13.349 4.839 1.00 71.14 H new ATOM 0 HG21 ILE A 126 3.302 13.733 2.362 1.00 41.11 H new ATOM 0 HG22 ILE A 126 4.928 13.375 1.733 1.00 41.11 H new ATOM 0 HG23 ILE A 126 3.802 12.046 2.097 1.00 41.11 H new ATOM 0 HD11 ILE A 126 2.133 11.038 5.278 1.00 11.03 H new ATOM 0 HD12 ILE A 126 2.467 11.274 3.546 1.00 11.03 H new ATOM 0 HD13 ILE A 126 3.663 10.455 4.579 1.00 11.03 H new ATOM 2133 N MET A 127 7.388 11.563 2.079 1.00 31.34 N ATOM 2134 CA MET A 127 8.205 11.942 0.932 1.00 12.21 C ATOM 2135 C MET A 127 7.306 12.719 -0.034 1.00 62.22 C ATOM 2136 O MET A 127 6.146 12.342 -0.244 1.00 71.51 O ATOM 2137 CB MET A 127 8.794 10.694 0.228 1.00 24.24 C ATOM 2138 CG MET A 127 9.629 9.775 1.132 1.00 43.41 C ATOM 2139 SD MET A 127 10.382 8.393 0.238 1.00 70.11 S ATOM 2140 CE MET A 127 8.980 7.697 -0.641 1.00 2.05 C ATOM 0 H MET A 127 7.136 10.575 2.100 1.00 31.34 H new ATOM 0 HA MET A 127 9.046 12.554 1.259 1.00 12.21 H new ATOM 0 HB2 MET A 127 7.975 10.114 -0.197 1.00 24.24 H new ATOM 0 HB3 MET A 127 9.416 11.024 -0.604 1.00 24.24 H new ATOM 0 HG2 MET A 127 10.414 10.361 1.610 1.00 43.41 H new ATOM 0 HG3 MET A 127 8.994 9.383 1.927 1.00 43.41 H new ATOM 0 HE1 MET A 127 9.289 6.788 -1.158 1.00 2.05 H new ATOM 0 HE2 MET A 127 8.187 7.459 0.068 1.00 2.05 H new ATOM 0 HE3 MET A 127 8.611 8.420 -1.368 1.00 2.05 H new ATOM 2150 N ILE A 128 7.843 13.799 -0.604 1.00 53.43 N ATOM 2151 CA ILE A 128 7.096 14.678 -1.523 1.00 74.32 C ATOM 2152 C ILE A 128 6.712 13.911 -2.817 1.00 21.23 C ATOM 2153 O ILE A 128 5.778 14.297 -3.520 1.00 63.21 O ATOM 2154 CB ILE A 128 7.936 15.981 -1.857 1.00 51.45 C ATOM 2155 CG1 ILE A 128 8.451 16.656 -0.539 1.00 73.22 C ATOM 2156 CG2 ILE A 128 7.123 17.001 -2.705 1.00 63.44 C ATOM 2157 CD1 ILE A 128 9.294 17.910 -0.739 1.00 60.03 C ATOM 0 H ILE A 128 8.807 14.094 -0.446 1.00 53.43 H new ATOM 0 HA ILE A 128 6.175 14.991 -1.031 1.00 74.32 H new ATOM 0 HB ILE A 128 8.792 15.668 -2.455 1.00 51.45 H new ATOM 0 HG12 ILE A 128 7.591 16.911 0.080 1.00 73.22 H new ATOM 0 HG13 ILE A 128 9.040 15.927 0.018 1.00 73.22 H new ATOM 0 HG21 ILE A 128 7.739 17.877 -2.909 1.00 63.44 H new ATOM 0 HG22 ILE A 128 6.827 16.538 -3.646 1.00 63.44 H new ATOM 0 HG23 ILE A 128 6.232 17.304 -2.154 1.00 63.44 H new ATOM 0 HD11 ILE A 128 9.601 18.301 0.231 1.00 60.03 H new ATOM 0 HD12 ILE A 128 10.178 17.664 -1.327 1.00 60.03 H new ATOM 0 HD13 ILE A 128 8.707 18.663 -1.264 1.00 60.03 H new ATOM 2169 N LYS A 129 7.432 12.796 -3.109 1.00 31.11 N ATOM 2170 CA LYS A 129 7.249 11.968 -4.333 1.00 42.35 C ATOM 2171 C LYS A 129 7.108 10.467 -3.942 1.00 4.34 C ATOM 2172 O LYS A 129 7.396 10.075 -2.807 1.00 64.23 O ATOM 2173 CB LYS A 129 8.438 12.150 -5.348 1.00 22.40 C ATOM 2174 CG LYS A 129 8.410 13.416 -6.257 1.00 44.12 C ATOM 2175 CD LYS A 129 8.513 14.741 -5.481 1.00 11.14 C ATOM 2176 CE LYS A 129 8.560 15.989 -6.372 1.00 33.12 C ATOM 2177 NZ LYS A 129 9.871 16.137 -7.055 1.00 4.31 N ATOM 0 H LYS A 129 8.165 12.442 -2.494 1.00 31.11 H new ATOM 0 HA LYS A 129 6.338 12.306 -4.828 1.00 42.35 H new ATOM 0 HB2 LYS A 129 9.368 12.162 -4.780 1.00 22.40 H new ATOM 0 HB3 LYS A 129 8.470 11.272 -5.993 1.00 22.40 H new ATOM 0 HG2 LYS A 129 9.233 13.358 -6.970 1.00 44.12 H new ATOM 0 HG3 LYS A 129 7.486 13.416 -6.836 1.00 44.12 H new ATOM 0 HD2 LYS A 129 7.660 14.822 -4.807 1.00 11.14 H new ATOM 0 HD3 LYS A 129 9.409 14.717 -4.861 1.00 11.14 H new ATOM 0 HE2 LYS A 129 7.767 15.932 -7.118 1.00 33.12 H new ATOM 0 HE3 LYS A 129 8.365 16.874 -5.767 1.00 33.12 H new ATOM 0 HZ1 LYS A 129 9.860 16.992 -7.646 1.00 4.31 H new ATOM 0 HZ2 LYS A 129 10.626 16.218 -6.344 1.00 4.31 H new ATOM 0 HZ3 LYS A 129 10.047 15.305 -7.653 1.00 4.31 H new ATOM 2191 N TYR A 130 6.642 9.652 -4.911 1.00 31.14 N ATOM 2192 CA TYR A 130 6.551 8.173 -4.814 1.00 30.03 C ATOM 2193 C TYR A 130 6.916 7.552 -6.182 1.00 70.32 C ATOM 2194 O TYR A 130 7.114 8.279 -7.165 1.00 24.05 O ATOM 2195 CB TYR A 130 5.122 7.738 -4.389 1.00 21.30 C ATOM 2196 CG TYR A 130 4.024 8.024 -5.436 1.00 63.52 C ATOM 2197 CD1 TYR A 130 3.472 9.292 -5.570 1.00 34.33 C ATOM 2198 CD2 TYR A 130 3.532 7.021 -6.283 1.00 60.12 C ATOM 2199 CE1 TYR A 130 2.483 9.552 -6.494 1.00 55.41 C ATOM 2200 CE2 TYR A 130 2.543 7.280 -7.212 1.00 55.05 C ATOM 2201 CZ TYR A 130 2.022 8.547 -7.310 1.00 0.24 C ATOM 2202 OH TYR A 130 1.024 8.811 -8.220 1.00 4.21 O ATOM 0 H TYR A 130 6.309 10.009 -5.807 1.00 31.14 H new ATOM 0 HA TYR A 130 7.250 7.821 -4.055 1.00 30.03 H new ATOM 0 HB2 TYR A 130 5.131 6.669 -4.174 1.00 21.30 H new ATOM 0 HB3 TYR A 130 4.862 8.248 -3.461 1.00 21.30 H new ATOM 0 HD1 TYR A 130 3.826 10.092 -4.936 1.00 34.33 H new ATOM 0 HD2 TYR A 130 3.936 6.022 -6.207 1.00 60.12 H new ATOM 0 HE1 TYR A 130 2.070 10.546 -6.577 1.00 55.41 H new ATOM 0 HE2 TYR A 130 2.182 6.492 -7.856 1.00 55.05 H new ATOM 0 HH TYR A 130 1.330 9.494 -8.853 1.00 4.21 H new ATOM 2212 N HIS A 131 7.007 6.211 -6.242 1.00 11.51 N ATOM 2213 CA HIS A 131 7.303 5.471 -7.492 1.00 72.54 C ATOM 2214 C HIS A 131 6.014 4.870 -8.083 1.00 20.11 C ATOM 2215 O HIS A 131 5.408 4.008 -7.453 1.00 31.42 O ATOM 2216 CB HIS A 131 8.328 4.354 -7.219 1.00 32.24 C ATOM 2217 CG HIS A 131 9.633 4.875 -6.711 1.00 74.51 C ATOM 2218 ND1 HIS A 131 10.588 5.325 -7.576 1.00 22.35 N ATOM 2219 CD2 HIS A 131 10.087 5.004 -5.439 1.00 22.33 C ATOM 2220 CE1 HIS A 131 11.590 5.714 -6.828 1.00 52.11 C ATOM 2221 NE2 HIS A 131 11.338 5.540 -5.524 1.00 51.03 N ATOM 0 H HIS A 131 6.879 5.607 -5.430 1.00 11.51 H new ATOM 0 HA HIS A 131 7.724 6.170 -8.214 1.00 72.54 H new ATOM 0 HB2 HIS A 131 7.913 3.657 -6.491 1.00 32.24 H new ATOM 0 HB3 HIS A 131 8.499 3.792 -8.137 1.00 32.24 H new ATOM 0 HD2 HIS A 131 9.560 4.735 -4.535 1.00 22.33 H new ATOM 0 HE1 HIS A 131 12.510 6.126 -7.216 1.00 52.11 H new ATOM 0 HE2 HIS A 131 11.960 5.764 -4.747 1.00 51.03 H new ATOM 2229 N PRO A 132 5.593 5.282 -9.324 1.00 52.34 N ATOM 2230 CA PRO A 132 4.309 4.836 -9.928 1.00 20.04 C ATOM 2231 C PRO A 132 4.327 3.370 -10.435 1.00 52.32 C ATOM 2232 O PRO A 132 3.296 2.865 -10.888 1.00 25.34 O ATOM 2233 CB PRO A 132 4.121 5.840 -11.088 1.00 55.34 C ATOM 2234 CG PRO A 132 5.511 6.203 -11.503 1.00 34.43 C ATOM 2235 CD PRO A 132 6.334 6.203 -10.235 1.00 52.43 C ATOM 0 HA PRO A 132 3.495 4.831 -9.203 1.00 20.04 H new ATOM 0 HB2 PRO A 132 3.565 5.393 -11.912 1.00 55.34 H new ATOM 0 HB3 PRO A 132 3.562 6.718 -10.765 1.00 55.34 H new ATOM 0 HG2 PRO A 132 5.904 5.486 -12.224 1.00 34.43 H new ATOM 0 HG3 PRO A 132 5.533 7.181 -11.983 1.00 34.43 H new ATOM 0 HD2 PRO A 132 7.349 5.852 -10.418 1.00 52.43 H new ATOM 0 HD3 PRO A 132 6.415 7.204 -9.811 1.00 52.43 H new ATOM 2243 N LYS A 133 5.499 2.699 -10.364 1.00 64.45 N ATOM 2244 CA LYS A 133 5.671 1.290 -10.799 1.00 35.14 C ATOM 2245 C LYS A 133 6.144 0.380 -9.645 1.00 11.14 C ATOM 2246 O LYS A 133 6.256 0.816 -8.499 1.00 62.22 O ATOM 2247 CB LYS A 133 6.647 1.217 -12.006 1.00 52.40 C ATOM 2248 CG LYS A 133 6.044 1.664 -13.356 1.00 35.14 C ATOM 2249 CD LYS A 133 4.778 0.853 -13.724 1.00 42.41 C ATOM 2250 CE LYS A 133 4.244 1.164 -15.130 1.00 40.52 C ATOM 2251 NZ LYS A 133 4.160 2.619 -15.389 1.00 21.52 N ATOM 0 H LYS A 133 6.356 3.119 -10.003 1.00 64.45 H new ATOM 0 HA LYS A 133 4.696 0.918 -11.113 1.00 35.14 H new ATOM 0 HB2 LYS A 133 7.517 1.837 -11.790 1.00 52.40 H new ATOM 0 HB3 LYS A 133 7.003 0.192 -12.105 1.00 52.40 H new ATOM 0 HG2 LYS A 133 5.794 2.724 -13.308 1.00 35.14 H new ATOM 0 HG3 LYS A 133 6.790 1.548 -14.142 1.00 35.14 H new ATOM 0 HD2 LYS A 133 5.004 -0.211 -13.656 1.00 42.41 H new ATOM 0 HD3 LYS A 133 3.997 1.060 -12.992 1.00 42.41 H new ATOM 0 HE2 LYS A 133 4.893 0.702 -15.873 1.00 40.52 H new ATOM 0 HE3 LYS A 133 3.256 0.718 -15.248 1.00 40.52 H new ATOM 0 HZ1 LYS A 133 3.641 2.785 -16.275 1.00 21.52 H new ATOM 0 HZ2 LYS A 133 3.661 3.083 -14.603 1.00 21.52 H new ATOM 0 HZ3 LYS A 133 5.119 3.013 -15.471 1.00 21.52 H new ATOM 2265 N PHE A 134 6.419 -0.902 -9.988 1.00 14.20 N ATOM 2266 CA PHE A 134 6.728 -1.969 -9.021 1.00 23.31 C ATOM 2267 C PHE A 134 8.243 -2.216 -8.945 1.00 35.53 C ATOM 2268 O PHE A 134 8.861 -2.590 -9.947 1.00 53.30 O ATOM 2269 CB PHE A 134 6.011 -3.283 -9.432 1.00 33.01 C ATOM 2270 CG PHE A 134 4.510 -3.148 -9.639 1.00 13.41 C ATOM 2271 CD1 PHE A 134 3.648 -3.173 -8.552 1.00 4.12 C ATOM 2272 CD2 PHE A 134 3.958 -2.992 -10.920 1.00 74.31 C ATOM 2273 CE1 PHE A 134 2.290 -3.052 -8.725 1.00 34.01 C ATOM 2274 CE2 PHE A 134 2.594 -2.871 -11.092 1.00 43.54 C ATOM 2275 CZ PHE A 134 1.763 -2.902 -9.997 1.00 14.43 C ATOM 0 H PHE A 134 6.431 -1.222 -10.957 1.00 14.20 H new ATOM 0 HA PHE A 134 6.375 -1.651 -8.040 1.00 23.31 H new ATOM 0 HB2 PHE A 134 6.460 -3.653 -10.354 1.00 33.01 H new ATOM 0 HB3 PHE A 134 6.192 -4.036 -8.665 1.00 33.01 H new ATOM 0 HD1 PHE A 134 4.050 -3.289 -7.556 1.00 4.12 H new ATOM 0 HD2 PHE A 134 4.609 -2.966 -11.782 1.00 74.31 H new ATOM 0 HE1 PHE A 134 1.633 -3.074 -7.868 1.00 34.01 H new ATOM 0 HE2 PHE A 134 2.181 -2.752 -12.083 1.00 43.54 H new ATOM 0 HZ PHE A 134 0.695 -2.809 -10.129 1.00 14.43 H new ATOM 2285 N TRP A 135 8.821 -1.996 -7.756 1.00 12.22 N ATOM 2286 CA TRP A 135 10.238 -2.283 -7.469 1.00 23.34 C ATOM 2287 C TRP A 135 10.540 -3.793 -7.540 1.00 52.02 C ATOM 2288 O TRP A 135 10.184 -4.561 -6.640 1.00 63.52 O ATOM 2289 CB TRP A 135 10.640 -1.691 -6.087 1.00 62.45 C ATOM 2290 CG TRP A 135 11.003 -0.224 -6.142 1.00 60.03 C ATOM 2291 CD1 TRP A 135 10.386 0.757 -6.869 1.00 34.44 C ATOM 2292 CD2 TRP A 135 12.079 0.416 -5.445 1.00 44.14 C ATOM 2293 NE1 TRP A 135 11.029 1.950 -6.682 1.00 62.12 N ATOM 2294 CE2 TRP A 135 12.061 1.772 -5.807 1.00 43.44 C ATOM 2295 CE3 TRP A 135 13.062 -0.029 -4.553 1.00 51.23 C ATOM 2296 CZ2 TRP A 135 12.977 2.687 -5.310 1.00 23.44 C ATOM 2297 CZ3 TRP A 135 13.972 0.884 -4.058 1.00 3.31 C ATOM 2298 CH2 TRP A 135 13.922 2.228 -4.443 1.00 1.22 C ATOM 0 H TRP A 135 8.316 -1.611 -6.958 1.00 12.22 H new ATOM 0 HA TRP A 135 10.841 -1.802 -8.239 1.00 23.34 H new ATOM 0 HB2 TRP A 135 9.814 -1.827 -5.388 1.00 62.45 H new ATOM 0 HB3 TRP A 135 11.487 -2.252 -5.693 1.00 62.45 H new ATOM 0 HD1 TRP A 135 9.520 0.611 -7.497 1.00 34.44 H new ATOM 0 HE1 TRP A 135 10.777 2.833 -7.126 1.00 62.12 H new ATOM 0 HE3 TRP A 135 13.108 -1.067 -4.258 1.00 51.23 H new ATOM 0 HZ2 TRP A 135 12.942 3.727 -5.600 1.00 23.44 H new ATOM 0 HZ3 TRP A 135 14.732 0.556 -3.365 1.00 3.31 H new ATOM 0 HH2 TRP A 135 14.650 2.918 -4.043 1.00 1.22 H new ATOM 2309 N THR A 136 11.148 -4.190 -8.658 1.00 32.41 N ATOM 2310 CA THR A 136 11.707 -5.529 -8.871 1.00 15.25 C ATOM 2311 C THR A 136 13.049 -5.370 -9.599 1.00 23.02 C ATOM 2312 O THR A 136 13.161 -4.545 -10.515 1.00 21.14 O ATOM 2313 CB THR A 136 10.728 -6.433 -9.707 1.00 34.01 C ATOM 2314 OG1 THR A 136 9.531 -6.686 -8.952 1.00 52.54 O ATOM 2315 CG2 THR A 136 11.366 -7.772 -10.142 1.00 72.24 C ATOM 0 H THR A 136 11.269 -3.575 -9.462 1.00 32.41 H new ATOM 0 HA THR A 136 11.851 -6.023 -7.910 1.00 15.25 H new ATOM 0 HB THR A 136 10.490 -5.884 -10.618 1.00 34.01 H new ATOM 0 HG1 THR A 136 8.925 -7.248 -9.478 1.00 52.54 H new ATOM 0 HG21 THR A 136 10.642 -8.351 -10.715 1.00 72.24 H new ATOM 0 HG22 THR A 136 12.242 -7.574 -10.759 1.00 72.24 H new ATOM 0 HG23 THR A 136 11.665 -8.337 -9.259 1.00 72.24 H new ATOM 2323 N ASP A 137 14.072 -6.123 -9.178 1.00 44.44 N ATOM 2324 CA ASP A 137 15.356 -6.166 -9.888 1.00 53.41 C ATOM 2325 C ASP A 137 15.140 -6.777 -11.284 1.00 1.03 C ATOM 2326 O ASP A 137 14.784 -7.956 -11.401 1.00 50.33 O ATOM 2327 CB ASP A 137 16.388 -6.977 -9.078 1.00 4.24 C ATOM 2328 CG ASP A 137 16.696 -6.352 -7.703 1.00 53.35 C ATOM 2329 OD1 ASP A 137 15.979 -6.648 -6.725 1.00 71.15 O ATOM 2330 OD2 ASP A 137 17.641 -5.542 -7.600 1.00 33.44 O ATOM 0 H ASP A 137 14.035 -6.713 -8.347 1.00 44.44 H new ATOM 0 HA ASP A 137 15.747 -5.155 -10.003 1.00 53.41 H new ATOM 0 HB2 ASP A 137 16.015 -7.991 -8.935 1.00 4.24 H new ATOM 0 HB3 ASP A 137 17.312 -7.055 -9.651 1.00 4.24 H new ATOM 2335 N GLY A 138 15.301 -5.937 -12.323 1.00 71.21 N ATOM 2336 CA GLY A 138 15.061 -6.331 -13.711 1.00 13.33 C ATOM 2337 C GLY A 138 13.573 -6.347 -14.039 1.00 4.20 C ATOM 2338 O GLY A 138 12.954 -7.412 -14.102 1.00 24.03 O ATOM 0 H GLY A 138 15.601 -4.968 -12.217 1.00 71.21 H new ATOM 0 HA2 GLY A 138 15.574 -5.640 -14.380 1.00 13.33 H new ATOM 0 HA3 GLY A 138 15.484 -7.320 -13.888 1.00 13.33 H new ATOM 2342 N SER A 139 12.992 -5.150 -14.225 1.00 10.24 N ATOM 2343 CA SER A 139 11.545 -4.985 -14.473 1.00 12.15 C ATOM 2344 C SER A 139 11.241 -3.697 -15.246 1.00 2.03 C ATOM 2345 O SER A 139 12.126 -2.866 -15.467 1.00 34.21 O ATOM 2346 CB SER A 139 10.800 -4.960 -13.127 1.00 1.14 C ATOM 2347 OG SER A 139 11.256 -3.906 -12.309 1.00 43.22 O ATOM 0 H SER A 139 13.508 -4.270 -14.208 1.00 10.24 H new ATOM 0 HA SER A 139 11.210 -5.826 -15.080 1.00 12.15 H new ATOM 0 HB2 SER A 139 9.730 -4.850 -13.303 1.00 1.14 H new ATOM 0 HB3 SER A 139 10.942 -5.910 -12.612 1.00 1.14 H new ATOM 0 HG SER A 139 12.007 -4.218 -11.762 1.00 43.22 H new ATOM 2353 N TYR A 140 9.974 -3.556 -15.668 1.00 22.41 N ATOM 2354 CA TYR A 140 9.427 -2.287 -16.164 1.00 62.24 C ATOM 2355 C TYR A 140 9.062 -1.394 -14.968 1.00 65.55 C ATOM 2356 O TYR A 140 7.935 -1.436 -14.454 1.00 42.24 O ATOM 2357 CB TYR A 140 8.196 -2.524 -17.100 1.00 13.05 C ATOM 2358 CG TYR A 140 8.556 -2.637 -18.584 1.00 13.13 C ATOM 2359 CD1 TYR A 140 8.613 -1.497 -19.387 1.00 71.55 C ATOM 2360 CD2 TYR A 140 8.846 -3.866 -19.181 1.00 51.51 C ATOM 2361 CE1 TYR A 140 8.940 -1.580 -20.721 1.00 72.02 C ATOM 2362 CE2 TYR A 140 9.176 -3.950 -20.523 1.00 52.44 C ATOM 2363 CZ TYR A 140 9.218 -2.805 -21.287 1.00 64.52 C ATOM 2364 OH TYR A 140 9.551 -2.882 -22.623 1.00 3.14 O ATOM 0 H TYR A 140 9.300 -4.322 -15.674 1.00 22.41 H new ATOM 0 HA TYR A 140 10.184 -1.783 -16.765 1.00 62.24 H new ATOM 0 HB2 TYR A 140 7.687 -3.436 -16.790 1.00 13.05 H new ATOM 0 HB3 TYR A 140 7.490 -1.704 -16.969 1.00 13.05 H new ATOM 0 HD1 TYR A 140 8.396 -0.532 -18.953 1.00 71.55 H new ATOM 0 HD2 TYR A 140 8.812 -4.766 -18.585 1.00 51.51 H new ATOM 0 HE1 TYR A 140 8.979 -0.685 -21.324 1.00 72.02 H new ATOM 0 HE2 TYR A 140 9.399 -4.908 -20.968 1.00 52.44 H new ATOM 0 HH TYR A 140 9.718 -3.817 -22.865 1.00 3.14 H new ATOM 2374 N GLN A 141 10.069 -0.663 -14.473 1.00 74.22 N ATOM 2375 CA GLN A 141 9.874 0.394 -13.481 1.00 34.22 C ATOM 2376 C GLN A 141 9.807 1.752 -14.177 1.00 4.11 C ATOM 2377 O GLN A 141 9.918 1.851 -15.405 1.00 74.52 O ATOM 2378 CB GLN A 141 11.003 0.401 -12.424 1.00 43.13 C ATOM 2379 CG GLN A 141 11.053 -0.836 -11.525 1.00 41.42 C ATOM 2380 CD GLN A 141 12.068 -0.722 -10.387 1.00 2.22 C ATOM 2381 OE1 GLN A 141 12.624 -1.844 -9.977 1.00 61.01 O flip ATOM 2382 NE2 GLN A 141 12.348 0.364 -9.890 1.00 43.11 N flip ATOM 0 H GLN A 141 11.042 -0.791 -14.752 1.00 74.22 H new ATOM 0 HA GLN A 141 8.934 0.198 -12.964 1.00 34.22 H new ATOM 0 HB2 GLN A 141 11.960 0.498 -12.937 1.00 43.13 H new ATOM 0 HB3 GLN A 141 10.887 1.284 -11.796 1.00 43.13 H new ATOM 0 HG2 GLN A 141 10.063 -1.009 -11.102 1.00 41.42 H new ATOM 0 HG3 GLN A 141 11.297 -1.707 -12.133 1.00 41.42 H new ATOM 0 HE21 GLN A 141 11.898 1.213 -10.232 1.00 43.11 H new ATOM 0 HE22 GLN A 141 13.031 0.418 -9.134 1.00 43.11 H new ATOM 2391 N CYS A 142 9.610 2.782 -13.363 1.00 63.00 N ATOM 2392 CA CYS A 142 9.643 4.175 -13.788 1.00 14.42 C ATOM 2393 C CYS A 142 11.107 4.633 -14.005 1.00 54.31 C ATOM 2394 O CYS A 142 11.468 5.095 -15.095 1.00 53.21 O ATOM 2395 CB CYS A 142 8.923 5.001 -12.709 1.00 51.42 C ATOM 2396 SG CYS A 142 9.307 4.468 -11.006 1.00 5.32 S ATOM 0 H CYS A 142 9.419 2.669 -12.367 1.00 63.00 H new ATOM 0 HA CYS A 142 9.135 4.313 -14.742 1.00 14.42 H new ATOM 0 HB2 CYS A 142 9.196 6.050 -12.823 1.00 51.42 H new ATOM 0 HB3 CYS A 142 7.847 4.933 -12.869 1.00 51.42 H new ATOM 0 HG CYS A 142 9.650 5.501 -10.295 1.00 5.32 H new ATOM 2401 N CYS A 143 11.948 4.471 -12.963 1.00 22.13 N ATOM 2402 CA CYS A 143 13.369 4.902 -12.982 1.00 63.13 C ATOM 2403 C CYS A 143 14.354 3.709 -12.944 1.00 64.22 C ATOM 2404 O CYS A 143 15.576 3.916 -13.038 1.00 44.12 O ATOM 2405 CB CYS A 143 13.612 5.821 -11.775 1.00 53.51 C ATOM 2406 SG CYS A 143 13.154 5.059 -10.188 1.00 2.12 S ATOM 0 H CYS A 143 11.666 4.039 -12.083 1.00 22.13 H new ATOM 0 HA CYS A 143 13.554 5.429 -13.918 1.00 63.13 H new ATOM 0 HB2 CYS A 143 14.665 6.100 -11.746 1.00 53.51 H new ATOM 0 HB3 CYS A 143 13.042 6.741 -11.907 1.00 53.51 H new ATOM 0 HG CYS A 143 11.889 4.760 -10.199 1.00 2.12 H new ATOM 2411 N ARG A 144 13.813 2.478 -12.762 1.00 50.51 N ATOM 2412 CA ARG A 144 14.593 1.202 -12.684 1.00 13.42 C ATOM 2413 C ARG A 144 15.415 1.090 -11.378 1.00 45.32 C ATOM 2414 O ARG A 144 16.156 0.113 -11.196 1.00 20.25 O ATOM 2415 CB ARG A 144 15.523 0.981 -13.928 1.00 3.32 C ATOM 2416 CG ARG A 144 14.807 0.926 -15.294 1.00 63.00 C ATOM 2417 CD ARG A 144 13.648 -0.081 -15.322 1.00 61.41 C ATOM 2418 NE ARG A 144 13.150 -0.346 -16.681 1.00 41.23 N ATOM 2419 CZ ARG A 144 12.434 0.497 -17.442 1.00 64.11 C ATOM 2420 NH1 ARG A 144 12.102 1.710 -17.015 1.00 41.13 N ATOM 2421 NH2 ARG A 144 12.039 0.100 -18.640 1.00 53.15 N ATOM 0 H ARG A 144 12.808 2.334 -12.663 1.00 50.51 H new ATOM 0 HA ARG A 144 13.845 0.409 -12.683 1.00 13.42 H new ATOM 0 HB2 ARG A 144 16.259 1.784 -13.956 1.00 3.32 H new ATOM 0 HB3 ARG A 144 16.072 0.050 -13.788 1.00 3.32 H new ATOM 0 HG2 ARG A 144 14.426 1.917 -15.539 1.00 63.00 H new ATOM 0 HG3 ARG A 144 15.529 0.662 -16.067 1.00 63.00 H new ATOM 0 HD2 ARG A 144 13.977 -1.018 -14.872 1.00 61.41 H new ATOM 0 HD3 ARG A 144 12.830 0.297 -14.709 1.00 61.41 H new ATOM 0 HE ARG A 144 13.370 -1.257 -17.083 1.00 41.23 H new ATOM 0 HH11 ARG A 144 12.392 2.021 -16.088 1.00 41.13 H new ATOM 0 HH12 ARG A 144 11.557 2.330 -17.614 1.00 41.13 H new ATOM 0 HH21 ARG A 144 12.279 -0.834 -18.973 1.00 53.15 H new ATOM 0 HH22 ARG A 144 11.494 0.728 -19.231 1.00 53.15 H new ATOM 2435 N GLN A 145 15.253 2.065 -10.462 1.00 74.15 N ATOM 2436 CA GLN A 145 16.017 2.117 -9.208 1.00 72.32 C ATOM 2437 C GLN A 145 15.469 1.071 -8.221 1.00 53.15 C ATOM 2438 O GLN A 145 14.290 1.084 -7.888 1.00 61.23 O ATOM 2439 CB GLN A 145 15.983 3.546 -8.603 1.00 42.25 C ATOM 2440 CG GLN A 145 16.625 4.619 -9.502 1.00 51.13 C ATOM 2441 CD GLN A 145 16.683 6.002 -8.847 1.00 72.14 C ATOM 2442 OE1 GLN A 145 17.668 6.363 -8.204 1.00 72.10 O ATOM 2443 NE2 GLN A 145 15.622 6.771 -8.986 1.00 51.25 N ATOM 0 H GLN A 145 14.591 2.833 -10.573 1.00 74.15 H new ATOM 0 HA GLN A 145 17.060 1.878 -9.414 1.00 72.32 H new ATOM 0 HB2 GLN A 145 14.947 3.822 -8.407 1.00 42.25 H new ATOM 0 HB3 GLN A 145 16.497 3.536 -7.642 1.00 42.25 H new ATOM 0 HG2 GLN A 145 17.636 4.306 -9.764 1.00 51.13 H new ATOM 0 HG3 GLN A 145 16.061 4.689 -10.432 1.00 51.13 H new ATOM 0 HE21 GLN A 145 14.821 6.442 -9.526 1.00 51.25 H new ATOM 0 HE22 GLN A 145 15.602 7.695 -8.554 1.00 51.25 H new ATOM 2452 N THR A 146 16.348 0.160 -7.785 1.00 61.55 N ATOM 2453 CA THR A 146 15.984 -1.014 -6.975 1.00 0.32 C ATOM 2454 C THR A 146 17.112 -1.366 -5.967 1.00 52.10 C ATOM 2455 O THR A 146 17.060 -2.394 -5.278 1.00 73.21 O ATOM 2456 CB THR A 146 15.658 -2.217 -7.933 1.00 42.23 C ATOM 2457 OG1 THR A 146 15.294 -3.392 -7.198 1.00 50.22 O ATOM 2458 CG2 THR A 146 16.817 -2.538 -8.900 1.00 31.43 C ATOM 0 H THR A 146 17.346 0.217 -7.987 1.00 61.55 H new ATOM 0 HA THR A 146 15.097 -0.789 -6.383 1.00 0.32 H new ATOM 0 HB THR A 146 14.805 -1.899 -8.533 1.00 42.23 H new ATOM 0 HG1 THR A 146 15.775 -3.406 -6.344 1.00 50.22 H new ATOM 0 HG21 THR A 146 16.537 -3.377 -9.538 1.00 31.43 H new ATOM 0 HG22 THR A 146 17.027 -1.666 -9.519 1.00 31.43 H new ATOM 0 HG23 THR A 146 17.707 -2.799 -8.327 1.00 31.43 H new ATOM 2466 N GLU A 147 18.128 -0.483 -5.883 1.00 33.11 N ATOM 2467 CA GLU A 147 19.266 -0.624 -4.962 1.00 0.23 C ATOM 2468 C GLU A 147 18.969 0.131 -3.644 1.00 74.32 C ATOM 2469 O GLU A 147 18.565 -0.482 -2.652 1.00 33.33 O ATOM 2470 CB GLU A 147 20.565 -0.110 -5.658 1.00 41.43 C ATOM 2471 CG GLU A 147 21.822 -0.031 -4.764 1.00 3.53 C ATOM 2472 CD GLU A 147 22.257 -1.389 -4.197 1.00 50.42 C ATOM 2473 OE1 GLU A 147 22.959 -2.141 -4.908 1.00 31.14 O ATOM 2474 OE2 GLU A 147 21.898 -1.711 -3.044 1.00 71.41 O ATOM 0 H GLU A 147 18.178 0.356 -6.461 1.00 33.11 H new ATOM 0 HA GLU A 147 19.419 -1.673 -4.709 1.00 0.23 H new ATOM 0 HB2 GLU A 147 20.784 -0.763 -6.503 1.00 41.43 H new ATOM 0 HB3 GLU A 147 20.368 0.882 -6.064 1.00 41.43 H new ATOM 0 HG2 GLU A 147 22.643 0.392 -5.342 1.00 3.53 H new ATOM 0 HG3 GLU A 147 21.628 0.653 -3.938 1.00 3.53 H new ATOM 2481 N LYS A 148 19.147 1.466 -3.651 1.00 50.44 N ATOM 2482 CA LYS A 148 18.911 2.314 -2.469 1.00 55.31 C ATOM 2483 C LYS A 148 17.455 2.802 -2.471 1.00 21.51 C ATOM 2484 O LYS A 148 16.833 2.891 -3.535 1.00 40.11 O ATOM 2485 CB LYS A 148 19.885 3.530 -2.461 1.00 13.34 C ATOM 2486 CG LYS A 148 19.969 4.281 -1.105 1.00 14.13 C ATOM 2487 CD LYS A 148 20.601 3.416 0.011 1.00 54.21 C ATOM 2488 CE LYS A 148 22.046 2.980 -0.306 1.00 15.45 C ATOM 2489 NZ LYS A 148 22.580 2.047 0.723 1.00 34.32 N ATOM 0 H LYS A 148 19.457 1.984 -4.473 1.00 50.44 H new ATOM 0 HA LYS A 148 19.094 1.725 -1.570 1.00 55.31 H new ATOM 0 HB2 LYS A 148 20.882 3.182 -2.731 1.00 13.34 H new ATOM 0 HB3 LYS A 148 19.573 4.234 -3.233 1.00 13.34 H new ATOM 0 HG2 LYS A 148 20.556 5.190 -1.232 1.00 14.13 H new ATOM 0 HG3 LYS A 148 18.968 4.588 -0.800 1.00 14.13 H new ATOM 0 HD2 LYS A 148 20.594 3.977 0.945 1.00 54.21 H new ATOM 0 HD3 LYS A 148 19.986 2.529 0.167 1.00 54.21 H new ATOM 0 HE2 LYS A 148 22.074 2.498 -1.283 1.00 15.45 H new ATOM 0 HE3 LYS A 148 22.686 3.860 -0.366 1.00 15.45 H new ATOM 0 HZ1 LYS A 148 23.553 1.777 0.475 1.00 34.32 H new ATOM 0 HZ2 LYS A 148 22.577 2.516 1.651 1.00 34.32 H new ATOM 0 HZ3 LYS A 148 21.984 1.196 0.763 1.00 34.32 H new ATOM 2503 N LEU A 149 16.935 3.127 -1.278 1.00 13.13 N ATOM 2504 CA LEU A 149 15.579 3.663 -1.096 1.00 52.12 C ATOM 2505 C LEU A 149 15.479 5.070 -1.721 1.00 74.01 C ATOM 2506 O LEU A 149 15.763 6.081 -1.066 1.00 52.25 O ATOM 2507 CB LEU A 149 15.236 3.697 0.422 1.00 55.44 C ATOM 2508 CG LEU A 149 15.277 2.319 1.163 1.00 63.52 C ATOM 2509 CD1 LEU A 149 15.270 2.514 2.694 1.00 73.41 C ATOM 2510 CD2 LEU A 149 14.125 1.391 0.698 1.00 63.22 C ATOM 0 H LEU A 149 17.450 3.024 -0.404 1.00 13.13 H new ATOM 0 HA LEU A 149 14.858 3.020 -1.600 1.00 52.12 H new ATOM 0 HB2 LEU A 149 15.932 4.375 0.917 1.00 55.44 H new ATOM 0 HB3 LEU A 149 14.239 4.122 0.540 1.00 55.44 H new ATOM 0 HG LEU A 149 16.212 1.825 0.899 1.00 63.52 H new ATOM 0 HD11 LEU A 149 15.299 1.541 3.185 1.00 73.41 H new ATOM 0 HD12 LEU A 149 16.142 3.096 2.991 1.00 73.41 H new ATOM 0 HD13 LEU A 149 14.364 3.043 2.989 1.00 73.41 H new ATOM 0 HD21 LEU A 149 14.183 0.443 1.232 1.00 63.22 H new ATOM 0 HD22 LEU A 149 13.167 1.867 0.907 1.00 63.22 H new ATOM 0 HD23 LEU A 149 14.214 1.210 -0.373 1.00 63.22 H new ATOM 2522 N ALA A 150 15.156 5.100 -3.026 1.00 44.12 N ATOM 2523 CA ALA A 150 14.921 6.342 -3.768 1.00 62.23 C ATOM 2524 C ALA A 150 13.637 7.021 -3.241 1.00 21.11 C ATOM 2525 O ALA A 150 12.619 6.342 -3.055 1.00 70.13 O ATOM 2526 CB ALA A 150 14.828 6.054 -5.279 1.00 0.40 C ATOM 0 H ALA A 150 15.051 4.259 -3.593 1.00 44.12 H new ATOM 0 HA ALA A 150 15.758 7.023 -3.615 1.00 62.23 H new ATOM 0 HB1 ALA A 150 14.653 6.986 -5.817 1.00 0.40 H new ATOM 0 HB2 ALA A 150 15.761 5.606 -5.622 1.00 0.40 H new ATOM 0 HB3 ALA A 150 14.004 5.366 -5.468 1.00 0.40 H new ATOM 2532 N PRO A 151 13.656 8.368 -2.985 1.00 74.41 N ATOM 2533 CA PRO A 151 12.502 9.091 -2.386 1.00 14.42 C ATOM 2534 C PRO A 151 11.372 9.435 -3.396 1.00 41.33 C ATOM 2535 O PRO A 151 10.546 10.321 -3.133 1.00 62.23 O ATOM 2536 CB PRO A 151 13.178 10.349 -1.799 1.00 53.43 C ATOM 2537 CG PRO A 151 14.334 10.628 -2.710 1.00 72.03 C ATOM 2538 CD PRO A 151 14.808 9.285 -3.230 1.00 33.32 C ATOM 0 HA PRO A 151 11.969 8.489 -1.650 1.00 14.42 H new ATOM 0 HB2 PRO A 151 12.487 11.191 -1.769 1.00 53.43 H new ATOM 0 HB3 PRO A 151 13.514 10.176 -0.777 1.00 53.43 H new ATOM 0 HG2 PRO A 151 14.032 11.277 -3.532 1.00 72.03 H new ATOM 0 HG3 PRO A 151 15.134 11.141 -2.176 1.00 72.03 H new ATOM 0 HD2 PRO A 151 15.059 9.335 -4.290 1.00 33.32 H new ATOM 0 HD3 PRO A 151 15.703 8.949 -2.706 1.00 33.32 H new ATOM 2546 N GLY A 152 11.337 8.714 -4.534 1.00 3.31 N ATOM 2547 CA GLY A 152 10.260 8.830 -5.520 1.00 62.45 C ATOM 2548 C GLY A 152 10.666 9.588 -6.773 1.00 53.42 C ATOM 2549 O GLY A 152 11.785 10.098 -6.864 1.00 0.11 O ATOM 0 H GLY A 152 12.056 8.038 -4.789 1.00 3.31 H new ATOM 0 HA2 GLY A 152 9.926 7.831 -5.801 1.00 62.45 H new ATOM 0 HA3 GLY A 152 9.409 9.333 -5.060 1.00 62.45 H new ATOM 2553 N CYS A 153 9.750 9.635 -7.755 1.00 74.43 N ATOM 2554 CA CYS A 153 9.928 10.416 -9.001 1.00 10.31 C ATOM 2555 C CYS A 153 8.586 10.926 -9.572 1.00 51.43 C ATOM 2556 O CYS A 153 8.573 11.639 -10.580 1.00 34.42 O ATOM 2557 CB CYS A 153 10.682 9.560 -10.033 1.00 54.42 C ATOM 2558 SG CYS A 153 10.007 7.883 -10.234 1.00 15.20 S ATOM 0 H CYS A 153 8.863 9.134 -7.712 1.00 74.43 H new ATOM 0 HA CYS A 153 10.515 11.304 -8.766 1.00 10.31 H new ATOM 0 HB2 CYS A 153 10.660 10.068 -10.997 1.00 54.42 H new ATOM 0 HB3 CYS A 153 11.728 9.487 -9.735 1.00 54.42 H new ATOM 0 HG CYS A 153 10.308 7.166 -9.192 1.00 15.20 H new ATOM 2563 N GLU A 154 7.470 10.589 -8.911 1.00 43.04 N ATOM 2564 CA GLU A 154 6.115 11.027 -9.309 1.00 72.51 C ATOM 2565 C GLU A 154 5.523 11.812 -8.125 1.00 72.43 C ATOM 2566 O GLU A 154 5.638 11.353 -6.993 1.00 20.30 O ATOM 2567 CB GLU A 154 5.229 9.786 -9.680 1.00 42.11 C ATOM 2568 CG GLU A 154 4.262 9.989 -10.871 1.00 62.43 C ATOM 2569 CD GLU A 154 3.254 11.127 -10.672 1.00 23.43 C ATOM 2570 OE1 GLU A 154 2.254 10.939 -9.949 1.00 0.03 O ATOM 2571 OE2 GLU A 154 3.465 12.223 -11.236 1.00 72.43 O ATOM 0 H GLU A 154 7.477 10.000 -8.078 1.00 43.04 H new ATOM 0 HA GLU A 154 6.151 11.663 -10.193 1.00 72.51 H new ATOM 0 HB2 GLU A 154 5.887 8.947 -9.908 1.00 42.11 H new ATOM 0 HB3 GLU A 154 4.645 9.504 -8.804 1.00 42.11 H new ATOM 0 HG2 GLU A 154 4.846 10.188 -11.769 1.00 62.43 H new ATOM 0 HG3 GLU A 154 3.717 9.061 -11.045 1.00 62.43 H new ATOM 2578 N LYS A 155 4.885 12.972 -8.386 1.00 61.11 N ATOM 2579 CA LYS A 155 4.408 13.880 -7.313 1.00 15.52 C ATOM 2580 C LYS A 155 3.347 13.187 -6.422 1.00 45.15 C ATOM 2581 O LYS A 155 2.339 12.679 -6.916 1.00 52.44 O ATOM 2582 CB LYS A 155 3.899 15.256 -7.902 1.00 21.51 C ATOM 2583 CG LYS A 155 3.143 15.221 -9.263 1.00 73.42 C ATOM 2584 CD LYS A 155 1.779 14.504 -9.217 1.00 62.34 C ATOM 2585 CE LYS A 155 1.060 14.463 -10.578 1.00 34.54 C ATOM 2586 NZ LYS A 155 0.119 13.316 -10.643 1.00 22.34 N ATOM 0 H LYS A 155 4.687 13.305 -9.329 1.00 61.11 H new ATOM 0 HA LYS A 155 5.256 14.113 -6.669 1.00 15.52 H new ATOM 0 HB2 LYS A 155 3.241 15.715 -7.164 1.00 21.51 H new ATOM 0 HB3 LYS A 155 4.761 15.914 -8.013 1.00 21.51 H new ATOM 0 HG2 LYS A 155 2.990 16.244 -9.606 1.00 73.42 H new ATOM 0 HG3 LYS A 155 3.774 14.728 -10.002 1.00 73.42 H new ATOM 0 HD2 LYS A 155 1.926 13.484 -8.862 1.00 62.34 H new ATOM 0 HD3 LYS A 155 1.138 15.005 -8.492 1.00 62.34 H new ATOM 0 HE2 LYS A 155 0.516 15.395 -10.735 1.00 34.54 H new ATOM 0 HE3 LYS A 155 1.794 14.383 -11.380 1.00 34.54 H new ATOM 0 HZ1 LYS A 155 -0.291 13.257 -11.597 1.00 22.34 H new ATOM 0 HZ2 LYS A 155 0.630 12.435 -10.431 1.00 22.34 H new ATOM 0 HZ3 LYS A 155 -0.642 13.451 -9.947 1.00 22.34 H new ATOM 2600 N TYR A 156 3.619 13.113 -5.104 1.00 61.35 N ATOM 2601 CA TYR A 156 2.714 12.486 -4.136 1.00 63.14 C ATOM 2602 C TYR A 156 1.641 13.493 -3.701 1.00 43.23 C ATOM 2603 O TYR A 156 1.963 14.580 -3.205 1.00 10.12 O ATOM 2604 CB TYR A 156 3.518 11.962 -2.908 1.00 40.34 C ATOM 2605 CG TYR A 156 2.652 11.291 -1.833 1.00 12.45 C ATOM 2606 CD1 TYR A 156 2.128 10.016 -2.029 1.00 11.11 C ATOM 2607 CD2 TYR A 156 2.330 11.942 -0.642 1.00 23.23 C ATOM 2608 CE1 TYR A 156 1.319 9.422 -1.080 1.00 52.21 C ATOM 2609 CE2 TYR A 156 1.512 11.348 0.302 1.00 40.00 C ATOM 2610 CZ TYR A 156 1.012 10.088 0.080 1.00 44.23 C ATOM 2611 OH TYR A 156 0.176 9.497 1.007 1.00 45.01 O ATOM 0 H TYR A 156 4.472 13.487 -4.687 1.00 61.35 H new ATOM 0 HA TYR A 156 2.220 11.635 -4.604 1.00 63.14 H new ATOM 0 HB2 TYR A 156 4.266 11.249 -3.254 1.00 40.34 H new ATOM 0 HB3 TYR A 156 4.057 12.795 -2.457 1.00 40.34 H new ATOM 0 HD1 TYR A 156 2.358 9.482 -2.939 1.00 11.11 H new ATOM 0 HD2 TYR A 156 2.727 12.929 -0.453 1.00 23.23 H new ATOM 0 HE1 TYR A 156 0.927 8.430 -1.251 1.00 52.21 H new ATOM 0 HE2 TYR A 156 1.267 11.874 1.213 1.00 40.00 H new ATOM 0 HH TYR A 156 -0.116 8.623 0.674 1.00 45.01 H new ATOM 2621 N ASN A 157 0.367 13.136 -3.912 1.00 11.05 N ATOM 2622 CA ASN A 157 -0.777 13.922 -3.437 1.00 61.34 C ATOM 2623 C ASN A 157 -1.150 13.483 -2.016 1.00 5.42 C ATOM 2624 O ASN A 157 -1.757 12.429 -1.812 1.00 74.22 O ATOM 2625 CB ASN A 157 -1.988 13.792 -4.413 1.00 14.11 C ATOM 2626 CG ASN A 157 -2.297 12.366 -4.851 1.00 22.24 C ATOM 2627 OD1 ASN A 157 -1.716 11.879 -5.816 1.00 64.55 O ATOM 2628 ND2 ASN A 157 -3.203 11.689 -4.159 1.00 44.52 N ATOM 0 H ASN A 157 0.101 12.291 -4.418 1.00 11.05 H new ATOM 0 HA ASN A 157 -0.498 14.975 -3.411 1.00 61.34 H new ATOM 0 HB2 ASN A 157 -2.872 14.210 -3.932 1.00 14.11 H new ATOM 0 HB3 ASN A 157 -1.791 14.396 -5.299 1.00 14.11 H new ATOM 0 HD21 ASN A 157 -3.436 10.732 -4.424 1.00 44.52 H new ATOM 0 HD22 ASN A 157 -3.667 12.125 -3.362 1.00 44.52 H new ATOM 2635 N LEU A 158 -0.718 14.268 -1.027 1.00 51.52 N ATOM 2636 CA LEU A 158 -1.121 14.071 0.369 1.00 54.42 C ATOM 2637 C LEU A 158 -2.456 14.796 0.603 1.00 72.51 C ATOM 2638 O LEU A 158 -3.447 14.196 1.029 1.00 65.15 O ATOM 2639 CB LEU A 158 -0.016 14.594 1.321 1.00 55.23 C ATOM 2640 CG LEU A 158 -0.248 14.311 2.836 1.00 65.43 C ATOM 2641 CD1 LEU A 158 -0.325 12.791 3.123 1.00 11.12 C ATOM 2642 CD2 LEU A 158 0.830 15.004 3.694 1.00 51.13 C ATOM 0 H LEU A 158 -0.083 15.054 -1.168 1.00 51.52 H new ATOM 0 HA LEU A 158 -1.255 13.010 0.578 1.00 54.42 H new ATOM 0 HB2 LEU A 158 0.934 14.148 1.027 1.00 55.23 H new ATOM 0 HB3 LEU A 158 0.081 15.671 1.181 1.00 55.23 H new ATOM 0 HG LEU A 158 -1.213 14.735 3.115 1.00 65.43 H new ATOM 0 HD11 LEU A 158 -0.487 12.630 4.189 1.00 11.12 H new ATOM 0 HD12 LEU A 158 -1.151 12.356 2.560 1.00 11.12 H new ATOM 0 HD13 LEU A 158 0.609 12.316 2.822 1.00 11.12 H new ATOM 0 HD21 LEU A 158 0.648 14.793 4.748 1.00 51.13 H new ATOM 0 HD22 LEU A 158 1.814 14.629 3.414 1.00 51.13 H new ATOM 0 HD23 LEU A 158 0.791 16.081 3.528 1.00 51.13 H new ATOM 2654 N PHE A 159 -2.456 16.097 0.293 1.00 1.43 N ATOM 2655 CA PHE A 159 -3.660 16.944 0.298 1.00 64.21 C ATOM 2656 C PHE A 159 -4.188 17.079 -1.144 1.00 51.53 C ATOM 2657 O PHE A 159 -5.398 16.994 -1.388 1.00 34.50 O ATOM 2658 CB PHE A 159 -3.324 18.337 0.888 1.00 35.43 C ATOM 2659 CG PHE A 159 -2.821 18.314 2.336 1.00 55.44 C ATOM 2660 CD1 PHE A 159 -3.716 18.370 3.403 1.00 22.10 C ATOM 2661 CD2 PHE A 159 -1.454 18.237 2.631 1.00 71.40 C ATOM 2662 CE1 PHE A 159 -3.266 18.347 4.711 1.00 15.51 C ATOM 2663 CE2 PHE A 159 -1.009 18.212 3.945 1.00 72.34 C ATOM 2664 CZ PHE A 159 -1.915 18.268 4.983 1.00 53.01 C ATOM 0 H PHE A 159 -1.610 16.601 0.028 1.00 1.43 H new ATOM 0 HA PHE A 159 -4.430 16.487 0.919 1.00 64.21 H new ATOM 0 HB2 PHE A 159 -2.567 18.809 0.262 1.00 35.43 H new ATOM 0 HB3 PHE A 159 -4.215 18.963 0.837 1.00 35.43 H new ATOM 0 HD1 PHE A 159 -4.776 18.432 3.206 1.00 22.10 H new ATOM 0 HD2 PHE A 159 -0.737 18.197 1.825 1.00 71.40 H new ATOM 0 HE1 PHE A 159 -3.976 18.391 5.524 1.00 15.51 H new ATOM 0 HE2 PHE A 159 0.048 18.149 4.155 1.00 72.34 H new ATOM 0 HZ PHE A 159 -1.569 18.250 6.006 1.00 53.01 H new